(1-cyano-3-phenyl-propyl) benzoate; 1-phenyl-N-(phenylmethyl)methanamine

Systemtic Name: (1-cyano-3-phenyl-propyl) benzoate; 1-phenyl-N-(phenylmethyl)methanamine Openeye Name: N-benzyl-1-phenyl-methanamine; (1-cyano-3-phenyl-propyl) benzoate CAS Name: benzoic acid (1-cyano-3-phenylpropyl) ester; 1-phenyl-N-(phenylmethyl)methanamine IUPAC Name: N-benzyl-1-phenylmethanamine; (1-cyano-3-phenylpropyl) benzoate Traditional Name: benzoic acid (1-cyano-3-phenyl-propyl) ester; dibenzylamine Formula: C31H30N2O2 MolecularWeight: 462.5821

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C#N)OC(=O)C2=CC=CC=C2.C1=CC=C(C=C1)CNCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CCC(C#N)OC(=O)C2=CC=CC=C2.C1=CC=C(C=C1)CNCC2=CC=CC=C2

InChI

InChI=1S/C17H15NO2.C14H15N/c18-13-16(12-11-14-7-3-1-4-8-14)20-17(19)15-9-5-2-6-10-15;1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14/h1-10,16H,11-12H2;1-10,15H,11-12H2