[2-(7-chloranyl-1,8-naphthyridin-2-yl)-3-oxidanylidene-1H-isoindol-1-yl] 4-prop-2-enoylpiperazine-1-carboxylate

Systemtic Name: [2-(7-chloranyl-1,8-naphthyridin-2-yl)-3-oxidanylidene-1H-isoindol-1-yl] 4-prop-2-enoylpiperazine-1-carboxylate Openeye Name: [2-(7-chloro-1,8-naphthyridin-2-yl)-3-oxo-isoindolin-1-yl] 4-prop-2-enoylpiperazine-1-carboxylate CAS Name: 4-(1-oxoprop-2-enyl)-1-piperazinecarboxylic acid [2-(7-chloro-1,8-naphthyridin-2-yl)-3-oxo-1H-isoindol-1-yl] ester IUPAC Name: [2-(7-chloro-1,8-naphthyridin-2-yl)-3-oxo-1H-isoindol-1-yl] 4-prop-2-enoylpiperazine-1-carboxylate Traditional Name: 4-acryloylpiperazine-1-carboxylic acid [2-(7-chloro-1,8-naphthyridin-2-yl)-3-keto-isoindolin-1-yl] ester Formula: C24H20ClN5O4 MolecularWeight: 477.8997

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)N1CCN(CC1)C(=O)OC2C3=CC=CC=C3C(=O)N2C4=NC5=C(C=C4)C=CC(=N5)Cl

Isomeric SMILES

C=CC(=O)N1CCN(CC1)C(=O)OC2C3=CC=CC=C3C(=O)N2C4=NC5=C(C=C4)C=CC(=N5)Cl

InChI

InChI=1S/C24H20ClN5O4/c1-2-20(31)28-11-13-29(14-12-28)24(33)34-23-17-6-4-3-5-16(17)22(32)30(23)19-10-8-15-7-9-18(25)26-21(15)27-19/h2-10,23H,1,11-14H2