2-[[4-[(5,7-diethyl-2-oxidanylidene-1,6-naphthyridin-1-yl)methyl]phenyl]amino]-2-phenyl-ethanoic acid

Systemtic Name: 2-[[4-[(5,7-diethyl-2-oxidanylidene-1,6-naphthyridin-1-yl)methyl]phenyl]amino]-2-phenyl-ethanoic acid Openeye Name: 2-[4-[(5,7-diethyl-2-oxo-1,6-naphthyridin-1-yl)methyl]anilino]-2-phenyl-acetic acid CAS Name: 2-[4-[(5,7-diethyl-2-oxo-1,6-naphthyridin-1-yl)methyl]anilino]-2-phenylacetic acid IUPAC Name: 2-[4-[(5,7-diethyl-2-oxo-1,6-naphthyridin-1-yl)methyl]anilino]-2-phenylacetic acid Traditional Name: 2-[4-[(5,7-diethyl-2-keto-1,6-naphthyridin-1-yl)methyl]anilino]-2-phenyl-acetic acid Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C2C=CC(=O)N(C2=C1)CC3=CC=C(C=C3)NC(C4=CC=CC=C4)C(=O)O)CC

Isomeric SMILES

CCC1=NC(=C2C=CC(=O)N(C2=C1)CC3=CC=C(C=C3)NC(C4=CC=CC=C4)C(=O)O)CC

InChI

InChI=1S/C27H27N3O3/c1-3-20-16-24-22(23(4-2)28-20)14-15-25(31)30(24)17-18-10-12-21(13-11-18)29-26(27(32)33)19-8-6-5-7-9-19/h5-16,26,29H,3-4,17H2,1-2H3,(H,32,33)