ethyl 2-ethenyl-1-[[(2S,4R)-1-[hexyl-[(2-methylpropan-2-yl)oxycarbonylamino]carbamoyl]-4-(7-methoxy-2-phenyl-quinolin-4-yl)oxy-pyrrolidin-2-yl]carbonylamino]cyclopropane-1-carboxylate

Systemtic Name: ethyl 2-ethenyl-1-[[(2S,4R)-1-[hexyl-[(2-methylpropan-2-yl)oxycarbonylamino]carbamoyl]-4-(7-methoxy-2-phenyl-quinolin-4-yl)oxy-pyrrolidin-2-yl]carbonylamino]cyclopropane-1-carboxylate Openeye Name: ethyl 1-[[(2S,4R)-1-[(tert-butoxycarbonylamino)-hexyl-carbamoyl]-4-[(7-methoxy-2-phenyl-4-quinolyl)oxy]pyrrolidine-2-carbonyl]amino]-2-vinyl-cyclopropanecarboxylate CAS Name: 2-ethenyl-1-[[[(2S,4R)-1-[[hexyl-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]amino]-oxomethyl]-4-[(7-methoxy-2-phenyl-4-quinolinyl)oxy]-2-pyrrolidinyl]-oxomethyl]amino]-1-cyclopropanecarboxylic acid ethyl ester IUPAC Name: ethyl 2-ethenyl-1-[[(2S,4R)-1-[hexyl-[(2-methylpropan-2-yl)oxycarbonylamino]carbamoyl]-4-(7-methoxy-2-phenylquinolin-4-yl)oxypyrrolidine-2-carbonyl]amino]cyclopropane-1-carboxylate Traditional Name: 1-[[(2S,4R)-1-[(tert-butoxycarbonylamino)-hexyl-carbamoyl]-4-[(7-methoxy-2-phenyl-4-quinolyl)oxy]prolyl]amino]-2-vinyl-cyclopropanecarboxylic acid ethyl ester Formula: C41H53N5O8 MolecularWeight: 743.88822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C(=O)N1CC(CC1C(=O)NC2(CC2C=C)C(=O)OCC)OC3=CC(=NC4=C3C=CC(=C4)OC)C5=CC=CC=C5)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCN(C(=O)N1C[C@@H](C[C@H]1C(=O)NC2(CC2C=C)C(=O)OCC)OC3=CC(=NC4=C3C=CC(=C4)OC)C5=CC=CC=C5)NC(=O)OC(C)(C)C

InChI

InChI=1S/C41H53N5O8/c1-8-11-12-16-21-46(44-38(49)54-40(4,5)6)39(50)45-26-30(23-34(45)36(47)43-41(25-28(41)9-2)37(48)52-10-3)53-35-24-32(27-17-14-13-15-18-27)42-33-22-29(51-7)19-20-31(33)35/h9,13-15,17-20,22,24,28,30,34H,2,8,10-12,16,21,23,25-26H2,1,3-7H3,(H,43,47)(H,44,49)/t28?,30-,34+,41?/m1/s1