ethyl 3-azanyl-5-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]benzoate

Systemtic Name: ethyl 3-azanyl-5-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]benzoate Openeye Name: ethyl 3-amino-5-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]benzoate CAS Name: 3-amino-5-[[4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazinyl]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-amino-5-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]benzoate Traditional Name: 3-amino-5-[[4-(2,3,4-trimethoxybenzyl)piperazino]methyl]benzoic acid ethyl ester Formula: C24H33N3O5 MolecularWeight: 443.53592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)N)CN2CCN(CC2)CC3=C(C(=C(C=C3)OC)OC)OC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)N)CN2CCN(CC2)CC3=C(C(=C(C=C3)OC)OC)OC

InChI

InChI=1S/C24H33N3O5/c1-5-32-24(28)19-12-17(13-20(25)14-19)15-26-8-10-27(11-9-26)16-18-6-7-21(29-2)23(31-4)22(18)30-3/h6-7,12-14H,5,8-11,15-16,25H2,1-4H3