[2-oxidanylidene-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl] (E)-3-quinolin-8-ylprop-2-enoate

Systemtic Name: [2-oxidanylidene-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl] (E)-3-quinolin-8-ylprop-2-enoate Openeye Name: [2-oxo-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl] (E)-3-(8-quinolyl)prop-2-enoate CAS Name: (E)-3-(8-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-8-ylprop-2-enoate Traditional Name: (E)-3-(8-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=CC=CC3=C2N=CC=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)COC(=O)/C=C/C2=CC=CC3=C2N=CC=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C25H24N4O4/c30-22(28-14-16-29(17-15-28)25(32)27-21-9-2-1-3-10-21)18-33-23(31)12-11-20-7-4-6-19-8-5-13-26-24(19)20/h1-13H,14-18H2,(H,27,32)/b12-11+