3-(3-methoxyphenyl)-3-[(4-methylphenyl)methyl-(4-methylpyridin-3-yl)carbonyl-amino]propanoic acid

Systemtic Name: 3-(3-methoxyphenyl)-3-[(4-methylphenyl)methyl-(4-methylpyridin-3-yl)carbonyl-amino]propanoic acid Openeye Name: 3-(3-methoxyphenyl)-3-[(4-methylpyridine-3-carbonyl)-(p-tolylmethyl)amino]propanoic acid CAS Name: 3-(3-methoxyphenyl)-3-[(4-methylphenyl)methyl-[(4-methyl-3-pyridinyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-(3-methoxyphenyl)-3-[(4-methylphenyl)methyl-(4-methylpyridine-3-carbonyl)amino]propanoic acid Traditional Name: 3-(3-methoxyphenyl)-3-[(4-methylbenzyl)-(4-methylnicotinoyl)amino]propionic acid Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C(CC(=O)O)C2=CC(=CC=C2)OC)C(=O)C3=C(C=CN=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(C(CC(=O)O)C2=CC(=CC=C2)OC)C(=O)C3=C(C=CN=C3)C

InChI

InChI=1S/C25H26N2O4/c1-17-7-9-19(10-8-17)16-27(25(30)22-15-26-12-11-18(22)2)23(14-24(28)29)20-5-4-6-21(13-20)31-3/h4-13,15,23H,14,16H2,1-3H3,(H,28,29)