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

Systemtic Name: 2-azanyl-4-[5-methyl-2-oxidanylidene-3-(phenylmethyl)pyridin-1-yl]-3-oxidanylidene-2-[(3-phenylphenyl)methyl]octanoic acid Openeye Name: 2-amino-4-(3-benzyl-5-methyl-2-oxo-1-pyridyl)-3-oxo-2-[(3-phenylphenyl)methyl]octanoic acid CAS Name: 2-amino-4-[5-methyl-2-oxo-3-(phenylmethyl)-1-pyridinyl]-3-oxo-2-[(3-phenylphenyl)methyl]octanoic acid IUPAC Name: 2-amino-4-(3-benzyl-5-methyl-2-oxopyridin-1-yl)-3-oxo-2-[(3-phenylphenyl)methyl]octanoic acid Traditional Name: 2-amino-4-(3-benzyl-2-keto-5-methyl-1-pyridyl)-3-keto-2-(3-phenylbenzyl)caprylic acid Formula: C34H36N2O4 MolecularWeight: 536.66064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H36N2O4/c1-3-4-18-30(36-23-24(2)19-29(32(36)38)20-25-12-7-5-8-13-25)31(37)34(35,33(39)40)22-26-14-11-17-28(21-26)27-15-9-6-10-16-27/h5-17,19,21,23,30H,3-4,18,20,22,35H2,1-2H3,(H,39,40)