ethyl 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-methyl-benzoate

Systemtic Name: ethyl 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-methyl-benzoate Openeye Name: ethyl 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-methyl-benzoate CAS Name: 3-[4-(3,3-diphenylpropyl)-1-piperazinyl]-2-methylbenzoic acid ethyl ester IUPAC Name: ethyl 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-methylbenzoate Traditional Name: 3-[4-(3,3-diphenylpropyl)piperazino]-2-methyl-benzoic acid ethyl ester Formula: C29H34N2O2 MolecularWeight: 442.59246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CC=C1)N2CCN(CC2)CCC(C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C(=CC=C1)N2CCN(CC2)CCC(C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C29H34N2O2/c1-3-33-29(32)26-15-10-16-28(23(26)2)31-21-19-30(20-22-31)18-17-27(24-11-6-4-7-12-24)25-13-8-5-9-14-25/h4-16,27H,3,17-22H2,1-2H3