2-ethenyl-1-[[1-[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]-4-quinolin-4-yloxy-pyrrolidin-2-yl]carbonylamino]cyclopropane-1-carboxylic acid

Systemtic Name: 2-ethenyl-1-[[1-[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]-4-quinolin-4-yloxy-pyrrolidin-2-yl]carbonylamino]cyclopropane-1-carboxylic acid Openeye Name: 1-[[1-[2-(tert-butoxycarbonylamino)-3-methyl-pentanoyl]-4-(4-quinolyloxy)pyrrolidine-2-carbonyl]amino]-2-vinyl-cyclopropanecarboxylic acid CAS Name: 2-ethenyl-1-[[[1-[3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopentyl]-4-(4-quinolinyloxy)-2-pyrrolidinyl]-oxomethyl]amino]-1-cyclopropanecarboxylic acid IUPAC Name: 2-ethenyl-1-[[1-[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]-4-quinolin-4-yloxypyrrolidine-2-carbonyl]amino]cyclopropane-1-carboxylic acid Traditional Name: 1-[[1-[2-(tert-butoxycarbonylamino)-3-methyl-pentanoyl]-4-(4-quinolyloxy)prolyl]amino]-2-vinyl-cyclopropanecarboxylic acid Formula: C31H40N4O7 MolecularWeight: 580.6719

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CC(CC1C(=O)NC2(CC2C=C)C(=O)O)OC3=CC=NC4=CC=CC=C43)NC(=O)OC(C)(C)C

Isomeric SMILES

CCC(C)C(C(=O)N1CC(CC1C(=O)NC2(CC2C=C)C(=O)O)OC3=CC=NC4=CC=CC=C43)NC(=O)OC(C)(C)C

InChI

InChI=1S/C31H40N4O7/c1-7-18(3)25(33-29(40)42-30(4,5)6)27(37)35-17-20(41-24-13-14-32-22-12-10-9-11-21(22)24)15-23(35)26(36)34-31(28(38)39)16-19(31)8-2/h8-14,18-20,23,25H,2,7,15-17H2,1,3-6H3,(H,33,40)(H,34,36)(H,38,39)