N-[4-(7-bromanyl-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-phenyl-benzamide

Systemtic Name: N-[4-(7-bromanyl-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-phenyl-benzamide Openeye Name: N-[4-(7-bromo-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-phenyl-benzamide CAS Name: N-[4-(7-bromo-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-phenylbenzamide IUPAC Name: N-[4-(7-bromo-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-phenylbenzamide Traditional Name: N-[4-(7-bromo-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-phenyl-benzamide Formula: C26H27BrN2O MolecularWeight: 463.40938

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)Br)CCCCNC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)Br)CCCCNC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H27BrN2O/c27-25-13-12-22-14-17-29(19-24(22)18-25)16-5-4-15-28-26(30)23-10-8-21(9-11-23)20-6-2-1-3-7-20/h1-3,6-13,18H,4-5,14-17,19H2,(H,28,30)