methyl 4-[[2-[4-(3-methoxyphenyl)piperazin-1-yl]ethanoylamino]methyl]benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)CC(=O)NCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)CC(=O)NCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H27N3O4/c1-28-20-5-3-4-19(14-20)25-12-10-24(11-13-25)16-21(26)23-15-17-6-8-18(9-7-17)22(27)29-2/h3-9,14H,10-13,15-16H2,1-2H3,(H,23,26)