methyl 4-[2-[4-(phenylmethyl)piperazin-1-yl]propyl]benzoate

Systemtic Name: methyl 4-[2-[4-(phenylmethyl)piperazin-1-yl]propyl]benzoate Openeye Name: methyl 4-[2-(4-benzylpiperazin-1-yl)propyl]benzoate CAS Name: 4-[2-[4-(phenylmethyl)-1-piperazinyl]propyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(4-benzylpiperazin-1-yl)propyl]benzoate Traditional Name: 4-[2-(4-benzylpiperazino)propyl]benzoic acid methyl ester Formula: C22H28N2O2 MolecularWeight: 352.46992

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)C(=O)OC)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(CC1=CC=C(C=C1)C(=O)OC)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O2/c1-18(16-19-8-10-21(11-9-19)22(25)26-2)24-14-12-23(13-15-24)17-20-6-4-3-5-7-20/h3-11,18H,12-17H2,1-2H3