1-(4-methyl-1,4-diazepan-4-ium-1-yl)-3,3-diphenyl-propan-1-one

Systemtic Name: 1-(4-methyl-1,4-diazepan-4-ium-1-yl)-3,3-diphenyl-propan-1-one Openeye Name: 1-(4-methyl-1,4-diazepan-4-ium-1-yl)-3,3-diphenyl-propan-1-one CAS Name: 1-(4-methyl-1,4-diazepan-4-ium-1-yl)-3,3-diphenyl-1-propanone IUPAC Name: 1-(4-methyl-1,4-diazepan-4-ium-1-yl)-3,3-diphenylpropan-1-one Traditional Name: 1-(4-methyl-1,4-diazepan-4-ium-1-yl)-3,3-diphenyl-propan-1-one Formula: C21H27N2O+ MolecularWeight: 323.45188

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCCN(CC1)C(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H26N2O/c1-22-13-8-14-23(16-15-22)21(24)17-20(18-9-4-2-5-10-18)19-11-6-3-7-12-19/h2-7,9-12,20H,8,13-17H2,1H3/p+1