2-[4-(phenylmethyl)piperazin-1-yl]ethyl 4-ethoxycarbonyloxy-3,5-dimethoxy-benzoate

Systemtic Name: 2-[4-(phenylmethyl)piperazin-1-yl]ethyl 4-ethoxycarbonyloxy-3,5-dimethoxy-benzoate Openeye Name: 2-(4-benzylpiperazin-1-yl)ethyl 4-ethoxycarbonyloxy-3,5-dimethoxy-benzoate CAS Name: 4-ethoxycarbonyloxy-3,5-dimethoxybenzoic acid 2-[4-(phenylmethyl)-1-piperazinyl]ethyl ester IUPAC Name: 2-(4-benzylpiperazin-1-yl)ethyl 4-ethoxycarbonyloxy-3,5-dimethoxybenzoate Traditional Name: 4-carbethoxyoxy-3,5-dimethoxy-benzoic acid 2-(4-benzylpiperazino)ethyl ester Formula: C25H32N2O7 MolecularWeight: 472.53078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC1=C(C=C(C=C1OC)C(=O)OCCN2CCN(CC2)CC3=CC=CC=C3)OC

Isomeric SMILES

CCOC(=O)OC1=C(C=C(C=C1OC)C(=O)OCCN2CCN(CC2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C25H32N2O7/c1-4-32-25(29)34-23-21(30-2)16-20(17-22(23)31-3)24(28)33-15-14-26-10-12-27(13-11-26)18-19-8-6-5-7-9-19/h5-9,16-17H,4,10-15,18H2,1-3H3