3,4-dimethyl-N-[2-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 3,4-dimethyl-N-[2-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-oxidanylidene-ethyl]benzamide Openeye Name: 3,4-dimethyl-N-[2-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-oxo-ethyl]benzamide CAS Name: 3,4-dimethyl-N-[2-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-oxoethyl]benzamide IUPAC Name: 3,4-dimethyl-N-[2-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-oxoethyl]benzamide Traditional Name: N-[2-keto-2-(4-methyl-1,4-diazepan-4-ium-1-yl)ethyl]-3,4-dimethyl-benzamide Formula: C17H26N3O2+ MolecularWeight: 304.40724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)N2CCC[NH+](CC2)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)N2CCC[NH+](CC2)C)C

InChI

InChI=1S/C17H25N3O2/c1-13-5-6-15(11-14(13)2)17(22)18-12-16(21)20-8-4-7-19(3)9-10-20/h5-6,11H,4,7-10,12H2,1-3H3,(H,18,22)/p+1