N-(2-bromanylprop-2-enyl)-3-methoxy-N,2-dimethyl-3,3-diphenyl-propan-1-amine hydrate hydrochloride

Systemtic Name: N-(2-bromanylprop-2-enyl)-3-methoxy-N,2-dimethyl-3,3-diphenyl-propan-1-amine hydrate hydrochloride Openeye Name: N-(2-bromoallyl)-3-methoxy-N,2-dimethyl-3,3-diphenyl-propan-1-amine hydrate hydrochloride CAS Name: N-(2-bromoprop-2-enyl)-3-methoxy-N,2-dimethyl-3,3-diphenyl-1-propanamine hydrate hydrochloride IUPAC Name: N-(2-bromoprop-2-enyl)-3-methoxy-N,2-dimethyl-3,3-diphenylpropan-1-amine hydrate hydrochloride Traditional Name: 2-bromoallyl-(3-methoxy-2-methyl-3,3-diphenyl-propyl)-methyl-amine hydrate hydrochloride Formula: C21H29BrClNO2 MolecularWeight: 442.81746

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(C)CC(=C)Br)C(C1=CC=CC=C1)(C2=CC=CC=C2)OC.O.Cl

Isomeric SMILES

CC(CN(C)CC(=C)Br)C(C1=CC=CC=C1)(C2=CC=CC=C2)OC.O.Cl

InChI

InChI=1S/C21H26BrNO.ClH.H2O/c1-17(15-23(3)16-18(2)22)21(24-4,19-11-7-5-8-12-19)20-13-9-6-10-14-20;;/h5-14,17H,2,15-16H2,1,3-4H3;1H;1H2