1H-isoindol-1-yl 1-butanoyl-2-(7-chloranyl-1,8-naphthyridin-2-yl)-3-oxidanylidene-piperidine-4-carboxylate

Systemtic Name: 1H-isoindol-1-yl 1-butanoyl-2-(7-chloranyl-1,8-naphthyridin-2-yl)-3-oxidanylidene-piperidine-4-carboxylate Openeye Name: 1H-isoindol-1-yl 1-butanoyl-2-(7-chloro-1,8-naphthyridin-2-yl)-3-oxo-piperidine-4-carboxylate CAS Name: 2-(7-chloro-1,8-naphthyridin-2-yl)-3-oxo-1-(1-oxobutyl)-4-piperidinecarboxylic acid 1H-isoindol-1-yl ester IUPAC Name: 1H-isoindol-1-yl 1-butanoyl-2-(7-chloro-1,8-naphthyridin-2-yl)-3-oxopiperidine-4-carboxylate Traditional Name: 1-butyryl-2-(7-chloro-1,8-naphthyridin-2-yl)-3-keto-isonipecotic acid 1H-isoindol-1-yl ester Formula: C26H23ClN4O4 MolecularWeight: 490.93822

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCC(C(=O)C1C2=NC3=C(C=C2)C=CC(=N3)Cl)C(=O)OC4C5=CC=CC=C5C=N4

Isomeric SMILES

CCCC(=O)N1CCC(C(=O)C1C2=NC3=C(C=C2)C=CC(=N3)Cl)C(=O)OC4C5=CC=CC=C5C=N4

InChI

InChI=1S/C26H23ClN4O4/c1-2-5-21(32)31-13-12-18(26(34)35-25-17-7-4-3-6-16(17)14-28-25)23(33)22(31)19-10-8-15-9-11-20(27)30-24(15)29-19/h3-4,6-11,14,18,22,25H,2,5,12-13H2,1H3