2-azanyl-2-[[4-(2,6-dimethoxyphenyl)phenyl]methyl]-4-[5-methyl-2-oxidanylidene-3-(phenylmethyl)pyridin-1-yl]-3-oxidanylidene-octanoic acid

Systemtic Name: 2-azanyl-2-[[4-(2,6-dimethoxyphenyl)phenyl]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-[[4-(2,6-dimethoxyphenyl)phenyl]methyl]-3-oxo-octanoic acid CAS Name: 2-amino-2-[[4-(2,6-dimethoxyphenyl)phenyl]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-[[4-(2,6-dimethoxyphenyl)phenyl]methyl]-3-oxooctanoic acid Traditional Name: 2-amino-4-(3-benzyl-2-keto-5-methyl-1-pyridyl)-2-[4-(2,6-dimethoxyphenyl)benzyl]-3-keto-caprylic acid Formula: C36H40N2O6 MolecularWeight: 596.7126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)C(CC1=CC=C(C=C1)C2=C(C=CC=C2OC)OC)(C(=O)O)N)N3C=C(C=C(C3=O)CC4=CC=CC=C4)C

Isomeric SMILES

CCCCC(C(=O)C(CC1=CC=C(C=C1)C2=C(C=CC=C2OC)OC)(C(=O)O)N)N3C=C(C=C(C3=O)CC4=CC=CC=C4)C

InChI

InChI=1S/C36H40N2O6/c1-5-6-13-29(38-23-24(2)20-28(34(38)40)21-25-11-8-7-9-12-25)33(39)36(37,35(41)42)22-26-16-18-27(19-17-26)32-30(43-3)14-10-15-31(32)44-4/h7-12,14-20,23,29H,5-6,13,21-22,37H2,1-4H3,(H,41,42)