3-[[1-[(2-chlorophenyl)methyl]-4-methyl-2-oxidanylidene-pyridin-3-yl]carbamoylamino]butanoic acid

Systemtic Name: 3-[[1-[(2-chlorophenyl)methyl]-4-methyl-2-oxidanylidene-pyridin-3-yl]carbamoylamino]butanoic acid Openeye Name: 3-[[1-[(2-chlorophenyl)methyl]-4-methyl-2-oxo-3-pyridyl]carbamoylamino]butanoic acid CAS Name: 3-[[[[1-[(2-chlorophenyl)methyl]-4-methyl-2-oxo-3-pyridinyl]amino]-oxomethyl]amino]butanoic acid IUPAC Name: 3-[[1-[(2-chlorophenyl)methyl]-4-methyl-2-oxopyridin-3-yl]carbamoylamino]butanoic acid Traditional Name: 3-[[1-(2-chlorobenzyl)-2-keto-4-methyl-3-pyridyl]carbamoylamino]butyric acid Formula: C18H20ClN3O4 MolecularWeight: 377.8221

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C=C1)CC2=CC=CC=C2Cl)NC(=O)NC(C)CC(=O)O

Isomeric SMILES

CC1=C(C(=O)N(C=C1)CC2=CC=CC=C2Cl)NC(=O)NC(C)CC(=O)O

InChI

InChI=1S/C18H20ClN3O4/c1-11-7-8-22(10-13-5-3-4-6-14(13)19)17(25)16(11)21-18(26)20-12(2)9-15(23)24/h3-8,12H,9-10H2,1-2H3,(H,23,24)(H2,20,21,26)