ethyl 4-[2-[3-oxidanylidene-1-(phenylcarbamoyl)piperazin-2-yl]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[3-oxidanylidene-1-(phenylcarbamoyl)piperazin-2-yl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[3-oxo-1-(phenylcarbamoyl)piperazin-2-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[1-[anilino(oxo)methyl]-3-oxo-2-piperazinyl]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[3-oxo-1-(phenylcarbamoyl)piperazin-2-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[3-keto-1-(phenylcarbamoyl)piperazin-2-yl]acetyl]amino]benzoic acid ethyl ester Formula: C22H24N4O5 MolecularWeight: 424.44976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)NCCN2C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)NCCN2C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H24N4O5/c1-2-31-21(29)15-8-10-17(11-9-15)24-19(27)14-18-20(28)23-12-13-26(18)22(30)25-16-6-4-3-5-7-16/h3-11,18H,2,12-14H2,1H3,(H,23,28)(H,24,27)(H,25,30)