[(1S)-1-cyclopropylethyl]-[[(4-methylphenyl)amino]methyl]-(phenylmethyl)azanium

Systemtic Name: [(1S)-1-cyclopropylethyl]-[[(4-methylphenyl)amino]methyl]-(phenylmethyl)azanium Openeye Name: benzyl-[(1S)-1-cyclopropylethyl]-[(4-methylanilino)methyl]ammonium CAS Name: [(1S)-1-cyclopropylethyl]-[(4-methylanilino)methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(1S)-1-cyclopropylethyl]-[(4-methylanilino)methyl]azanium Traditional Name: benzyl-[(1S)-1-cyclopropylethyl]-(p-toluidinomethyl)ammonium Formula: C20H27N2+ MolecularWeight: 295.44178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC[NH+](CC2=CC=CC=C2)C(C)C3CC3

Isomeric SMILES

CC1=CC=C(C=C1)NC[NH+](CC2=CC=CC=C2)[C@@H](C)C3CC3

InChI

InChI=1S/C20H26N2/c1-16-8-12-20(13-9-16)21-15-22(17(2)19-10-11-19)14-18-6-4-3-5-7-18/h3-9,12-13,17,19,21H,10-11,14-15H2,1-2H3/p+1/t17-/m0/s1