N-(4-bromanyl-3-methyl-phenyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)piperidine-1-carboxamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)piperidine-1-carboxamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)piperidine-1-carboxamide CAS Name: N-(4-bromo-3-methylphenyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1-piperidinecarboxamide IUPAC Name: N-(4-bromo-3-methylphenyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)piperidine-1-carboxamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)piperidine-1-carboxamide Formula: C23H28BrN3O MolecularWeight: 442.39192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)N2CCC(CC2)CN3CCC4=CC=CC=C4C3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)N2CCC(CC2)CN3CCC4=CC=CC=C4C3)Br

InChI

InChI=1S/C23H28BrN3O/c1-17-14-21(6-7-22(17)24)25-23(28)27-12-8-18(9-13-27)15-26-11-10-19-4-2-3-5-20(19)16-26/h2-7,14,18H,8-13,15-16H2,1H3,(H,25,28)