methyl 3-[2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]ethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[4-(4-chlorobenzoyl)piperazin-1-yl]acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[4-(4-chlorobenzoyl)piperazin-1-yl]acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[4-(4-chlorobenzoyl)piperazino]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C22H24ClN3O4 MolecularWeight: 429.89666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H24ClN3O4/c1-15-3-4-17(22(29)30-2)13-19(15)24-20(27)14-25-9-11-26(12-10-25)21(28)16-5-7-18(23)8-6-16/h3-8,13H,9-12,14H2,1-2H3,(H,24,27)