1-ethenyl-4-oxidanylidene-7-[4-(phenylmethyl)piperazin-1-yl]-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 1-ethenyl-4-oxidanylidene-7-[4-(phenylmethyl)piperazin-1-yl]-1,8-naphthyridine-3-carboxylic acid Openeye Name: 7-(4-benzylpiperazin-1-yl)-4-oxo-1-vinyl-1,8-naphthyridine-3-carboxylic acid CAS Name: 1-ethenyl-4-oxo-7-[4-(phenylmethyl)-1-piperazinyl]-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 7-(4-benzylpiperazin-1-yl)-1-ethenyl-4-oxo-1,8-naphthyridine-3-carboxylic acid Traditional Name: 7-(4-benzylpiperazino)-4-keto-1-vinyl-1,8-naphthyridine-3-carboxylic acid Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

C=CN1C=C(C(=O)C2=C1N=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C=CN1C=C(C(=O)C2=C1N=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C22H22N4O3/c1-2-25-15-18(22(28)29)20(27)17-8-9-19(23-21(17)25)26-12-10-24(11-13-26)14-16-6-4-3-5-7-16/h2-9,15H,1,10-14H2,(H,28,29)