2-azanyl-2-[(3,5-dimethoxyphenyl)methyl]-4-[5-methyl-2-oxidanylidene-3-(phenylmethyl)pyridin-1-yl]-3-oxidanylidene-octanoic acid

Systemtic Name: 2-azanyl-2-[(3,5-dimethoxyphenyl)methyl]-4-[5-methyl-2-oxidanylidene-3-(phenylmethyl)pyridin-1-yl]-3-oxidanylidene-octanoic acid Openeye Name: 2-amino-4-(3-benzyl-5-methyl-2-oxo-1-pyridyl)-2-[(3,5-dimethoxyphenyl)methyl]-3-oxo-octanoic acid CAS Name: 2-amino-2-[(3,5-dimethoxyphenyl)methyl]-4-[5-methyl-2-oxo-3-(phenylmethyl)-1-pyridinyl]-3-oxooctanoic acid IUPAC Name: 2-amino-4-(3-benzyl-5-methyl-2-oxopyridin-1-yl)-2-[(3,5-dimethoxyphenyl)methyl]-3-oxooctanoic acid Traditional Name: 2-amino-4-(3-benzyl-2-keto-5-methyl-1-pyridyl)-2-(3,5-dimethoxybenzyl)-3-keto-caprylic acid Formula: C30H36N2O6 MolecularWeight: 520.61664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)C(CC1=CC(=CC(=C1)OC)OC)(C(=O)O)N)N2C=C(C=C(C2=O)CC3=CC=CC=C3)C

Isomeric SMILES

CCCCC(C(=O)C(CC1=CC(=CC(=C1)OC)OC)(C(=O)O)N)N2C=C(C=C(C2=O)CC3=CC=CC=C3)C

InChI

InChI=1S/C30H36N2O6/c1-5-6-12-26(32-19-20(2)13-23(28(32)34)14-21-10-8-7-9-11-21)27(33)30(31,29(35)36)18-22-15-24(37-3)17-25(16-22)38-4/h7-11,13,15-17,19,26H,5-6,12,14,18,31H2,1-4H3,(H,35,36)