1-(3-cyanopropyl)-4-(3-methoxyphenyl)-2-oxidanylidene-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 1-(3-cyanopropyl)-4-(3-methoxyphenyl)-2-oxidanylidene-1,8-naphthyridine-3-carboxylic acid Openeye Name: 1-(3-cyanopropyl)-4-(3-methoxyphenyl)-2-oxo-1,8-naphthyridine-3-carboxylic acid CAS Name: 1-(3-cyanopropyl)-4-(3-methoxyphenyl)-2-oxo-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 1-(3-cyanopropyl)-4-(3-methoxyphenyl)-2-oxo-1,8-naphthyridine-3-carboxylic acid Traditional Name: 1-(3-cyanopropyl)-2-keto-4-(3-methoxyphenyl)-1,8-naphthyridine-3-carboxylic acid Formula: C20H17N3O4 MolecularWeight: 363.36668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C(C(=O)N(C3=C2C=CC=N3)CCCC#N)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C2=C(C(=O)N(C3=C2C=CC=N3)CCCC#N)C(=O)O

InChI

InChI=1S/C20H17N3O4/c1-27-14-7-4-6-13(12-14)16-15-8-5-10-22-18(15)23(11-3-2-9-21)19(24)17(16)20(25)26/h4-8,10,12H,2-3,11H2,1H3,(H,25,26)