4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[3-(3-methylphenyl)propyl]benzamide

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[3-(3-methylphenyl)propyl]benzamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[3-(m-tolyl)propyl]benzamide CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[3-(3-methylphenyl)propyl]benzamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[3-(3-methylphenyl)propyl]benzamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[3-(m-tolyl)propyl]benzamide Formula: C27H30N2O MolecularWeight: 398.5399

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCCNC(=O)C2=CC=C(C=C2)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC(=CC=C1)CCCNC(=O)C2=CC=C(C=C2)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C27H30N2O/c1-21-6-4-7-22(18-21)8-5-16-28-27(30)25-13-11-23(12-14-25)19-29-17-15-24-9-2-3-10-26(24)20-29/h2-4,6-7,9-14,18H,5,8,15-17,19-20H2,1H3,(H,28,30)