3-[[1-[(2-chlorophenyl)methyl]-5-methyl-2-oxidanyl-4-oxidanylidene-pyridin-3-yl]carbamoylamino]-3-naphthalen-2-yl-propanoic acid

Systemtic Name: 3-[[1-[(2-chlorophenyl)methyl]-5-methyl-2-oxidanyl-4-oxidanylidene-pyridin-3-yl]carbamoylamino]-3-naphthalen-2-yl-propanoic acid Openeye Name: 3-[[1-[(2-chlorophenyl)methyl]-2-hydroxy-5-methyl-4-oxo-3-pyridyl]carbamoylamino]-3-(2-naphthyl)propanoic acid CAS Name: 3-[[[[1-[(2-chlorophenyl)methyl]-2-hydroxy-5-methyl-4-oxo-3-pyridinyl]amino]-oxomethyl]amino]-3-(2-naphthalenyl)propanoic acid IUPAC Name: 3-[[1-[(2-chlorophenyl)methyl]-2-hydroxy-5-methyl-4-oxopyridin-3-yl]carbamoylamino]-3-naphthalen-2-ylpropanoic acid Traditional Name: 3-[[1-(2-chlorobenzyl)-2-hydroxy-4-keto-5-methyl-3-pyridyl]carbamoylamino]-3-(2-naphthyl)propionic acid Formula: C27H24ClN3O5 MolecularWeight: 505.94956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=C(C1=O)NC(=O)NC(CC(=O)O)C2=CC3=CC=CC=C3C=C2)O)CC4=CC=CC=C4Cl

Isomeric SMILES

CC1=CN(C(=C(C1=O)NC(=O)NC(CC(=O)O)C2=CC3=CC=CC=C3C=C2)O)CC4=CC=CC=C4Cl

InChI

InChI=1S/C27H24ClN3O5/c1-16-14-31(15-20-8-4-5-9-21(20)28)26(35)24(25(16)34)30-27(36)29-22(13-23(32)33)19-11-10-17-6-2-3-7-18(17)12-19/h2-12,14,22,35H,13,15H2,1H3,(H,32,33)(H2,29,30,36)