azepan-1-yl-[1-(4-bromanyl-3,5-dimethoxy-phenyl)carbonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-(4-bromanyl-3,5-dimethoxy-phenyl)carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-(4-bromo-3,5-dimethoxy-benzoyl)-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[(4-bromo-3,5-dimethoxyphenyl)-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(4-bromo-3,5-dimethoxybenzoyl)piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-(4-bromo-3,5-dimethoxy-benzoyl)-4-piperidyl]methanone Formula: C21H29BrN2O4 MolecularWeight: 453.36996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1Br)OC)C(=O)N2CCC(CC2)C(=O)N3CCCCCC3

Isomeric SMILES

COC1=CC(=CC(=C1Br)OC)C(=O)N2CCC(CC2)C(=O)N3CCCCCC3

InChI

InChI=1S/C21H29BrN2O4/c1-27-17-13-16(14-18(28-2)19(17)22)21(26)24-11-7-15(8-12-24)20(25)23-9-5-3-4-6-10-23/h13-15H,3-12H2,1-2H3