ditert-butyl 2-methyl-6-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-3-phenylmethoxy-propyl]-4-phenyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: ditert-butyl 2-methyl-6-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-3-phenylmethoxy-propyl]-4-phenyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: ditert-butyl 2-[(2S)-3-benzyloxy-2-(tert-butoxycarbonylamino)-3-oxo-propyl]-6-methyl-4-phenyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-methyl-6-[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxo-3-phenylmethoxypropyl]-4-phenyl-1,4-dihydropyridine-3,5-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-methyl-6-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxo-3-phenylmethoxypropyl]-4-phenyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-[(2S)-3-benzoxy-2-(tert-butoxycarbonylamino)-3-keto-propyl]-6-methyl-4-phenyl-1,4-dihydropyridine-3,5-dicarboxylic acid ditert-butyl ester Formula: C37H48N2O8 MolecularWeight: 648.78562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)CC(C(=O)OCC2=CC=CC=C2)NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C(C(=C(N1)C[C@@H](C(=O)OCC2=CC=CC=C2)NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C37H48N2O8/c1-23-28(32(41)45-35(2,3)4)29(25-19-15-12-16-20-25)30(33(42)46-36(5,6)7)26(38-23)21-27(39-34(43)47-37(8,9)10)31(40)44-22-24-17-13-11-14-18-24/h11-20,27,29,38H,21-22H2,1-10H3,(H,39,43)/t27-,29?/m0/s1