1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-(4-methoxyphenyl)azepan-1-yl]ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-(4-methoxyphenyl)azepan-1-yl]ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-(4-methoxyphenyl)azepan-1-yl]ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-(4-methoxyphenyl)-1-azepanyl]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-(4-methoxyphenyl)azepan-1-yl]ethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-(4-methoxyphenyl)azepan-1-yl]ethanone Formula: C24H30N2O2 MolecularWeight: 378.5072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2CC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCCCN2CC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C24H30N2O2/c1-28-22-12-10-20(11-13-22)23-9-3-2-6-15-25(23)18-24(27)26-16-14-19-7-4-5-8-21(19)17-26/h4-5,7-8,10-13,23H,2-3,6,9,14-18H2,1H3