[1-[(5-bromanyl-2-methoxy-phenyl)methyl]piperidin-3-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: [1-[(5-bromanyl-2-methoxy-phenyl)methyl]piperidin-3-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: [1-[(5-bromo-2-methoxy-phenyl)methyl]-3-piperidyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [1-[(5-bromo-2-methoxyphenyl)methyl]-3-piperidinyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: [1-[(5-bromo-2-methoxyphenyl)methyl]piperidin-3-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [1-(5-bromo-2-methoxy-benzyl)-3-piperidyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C23H27BrN2O2 MolecularWeight: 443.37668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CN2CCCC(C2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CN2CCCC(C2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H27BrN2O2/c1-28-22-9-8-21(24)13-20(22)15-25-11-4-7-19(14-25)23(27)26-12-10-17-5-2-3-6-18(17)16-26/h2-3,5-6,8-9,13,19H,4,7,10-12,14-16H2,1H3