2-[2-[3-(2-azanyl-2-oxidanylidene-ethyl)-6-butyl-4-methyl-2-oxidanylidene-pyridin-1-yl]phenyl]benzoic acid

Systemtic Name: 2-[2-[3-(2-azanyl-2-oxidanylidene-ethyl)-6-butyl-4-methyl-2-oxidanylidene-pyridin-1-yl]phenyl]benzoic acid Openeye Name: 2-[2-[3-(2-amino-2-oxo-ethyl)-6-butyl-4-methyl-2-oxo-1-pyridyl]phenyl]benzoic acid CAS Name: 2-[2-[3-(2-amino-2-oxoethyl)-6-butyl-4-methyl-2-oxo-1-pyridinyl]phenyl]benzoic acid IUPAC Name: 2-[2-[3-(2-amino-2-oxoethyl)-6-butyl-4-methyl-2-oxopyridin-1-yl]phenyl]benzoic acid Traditional Name: 2-[2-[3-(2-amino-2-keto-ethyl)-6-butyl-2-keto-4-methyl-1-pyridyl]phenyl]benzoic acid Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C(=O)N1C2=CC=CC=C2C3=CC=CC=C3C(=O)O)CC(=O)N)C

Isomeric SMILES

CCCCC1=CC(=C(C(=O)N1C2=CC=CC=C2C3=CC=CC=C3C(=O)O)CC(=O)N)C

InChI

InChI=1S/C25H26N2O4/c1-3-4-9-17-14-16(2)21(15-23(26)28)24(29)27(17)22-13-8-7-11-19(22)18-10-5-6-12-20(18)25(30)31/h5-8,10-14H,3-4,9,15H2,1-2H3,(H2,26,28)(H,30,31)