methyl 3-[[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]carbonylamino]benzoate

Systemtic Name: methyl 3-[[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]carbonylamino]benzoate Openeye Name: methyl 3-[[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1-carbonyl]amino]benzoate CAS Name: 3-[[[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1-carbonyl]amino]benzoate Traditional Name: 3-[(4-veratrylpiperazine-1-carbonyl)amino]benzoic acid methyl ester Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)NC3=CC=CC(=C3)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)NC3=CC=CC(=C3)C(=O)OC)OC

InChI

InChI=1S/C22H27N3O5/c1-28-19-8-7-16(13-20(19)29-2)15-24-9-11-25(12-10-24)22(27)23-18-6-4-5-17(14-18)21(26)30-3/h4-8,13-14H,9-12,15H2,1-3H3,(H,23,27)