methyl 4-[[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]amino]-3-methyl-benzoate

Systemtic Name: methyl 4-[[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]amino]-3-methyl-benzoate Openeye Name: methyl 4-[[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]amino]-3-methyl-benzoate CAS Name: 4-[[2-[4-(4-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]amino]-3-methylbenzoic acid methyl ester IUPAC Name: methyl 4-[[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]amino]-3-methylbenzoate Traditional Name: 4-[[2-keto-2-[4-(4-methoxyphenyl)piperazino]ethyl]amino]-3-methyl-benzoic acid methyl ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC)NCC(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC)NCC(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H27N3O4/c1-16-14-17(22(27)29-3)4-9-20(16)23-15-21(26)25-12-10-24(11-13-25)18-5-7-19(28-2)8-6-18/h4-9,14,23H,10-13,15H2,1-3H3