[2-oxidanylidene-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl] (E)-3-quinolin-2-ylprop-2-enoate

Systemtic Name: [2-oxidanylidene-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl] (E)-3-quinolin-2-ylprop-2-enoate Openeye Name: [2-oxo-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl] (E)-3-(2-quinolyl)prop-2-enoate CAS Name: (E)-3-(2-quinolinyl)-2-propenoic acid [2-[4-[anilino(oxo)methyl]-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-oxo-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl] (E)-3-quinolin-2-ylprop-2-enoate Traditional Name: (E)-3-(2-quinolyl)acrylic acid [2-keto-2-[4-(phenylcarbamoyl)piperazino]ethyl] ester Formula: C25H24N4O4 MolecularWeight: 444.48246

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC(=O)C=CC2=NC3=CC=CC=C3C=C2)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)COC(=O)/C=C/C2=NC3=CC=CC=C3C=C2)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C25H24N4O4/c30-23(28-14-16-29(17-15-28)25(32)27-20-7-2-1-3-8-20)18-33-24(31)13-12-21-11-10-19-6-4-5-9-22(19)26-21/h1-13H,14-18H2,(H,27,32)/b13-12+