4-[3-(phenylmethyl)phenyl]-3-propan-2-yl-piperazine-1-carboxylic acid

Systemtic Name: 4-[3-(phenylmethyl)phenyl]-3-propan-2-yl-piperazine-1-carboxylic acid Openeye Name: 4-(3-benzylphenyl)-3-isopropyl-piperazine-1-carboxylic acid CAS Name: 4-[3-(phenylmethyl)phenyl]-3-propan-2-yl-1-piperazinecarboxylic acid IUPAC Name: 4-(3-benzylphenyl)-3-propan-2-ylpiperazine-1-carboxylic acid Traditional Name: 4-(3-benzylphenyl)-3-isopropyl-piperazine-1-carboxylic acid Formula: C21H26N2O2 MolecularWeight: 338.44334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CN(CCN1C2=CC=CC(=C2)CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)C1CN(CCN1C2=CC=CC(=C2)CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H26N2O2/c1-16(2)20-15-22(21(24)25)11-12-23(20)19-10-6-9-18(14-19)13-17-7-4-3-5-8-17/h3-10,14,16,20H,11-13,15H2,1-2H3,(H,24,25)