2-[4-[3-(ethylcarbamoyl)pyridin-2-yl]-7-oxidanylidene-1,4-diazepan-1-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[4-[3-(ethylcarbamoyl)pyridin-2-yl]-7-oxidanylidene-1,4-diazepan-1-yl]ethyl-dimethyl-azanium Openeye Name: 2-[4-[3-(ethylcarbamoyl)-2-pyridyl]-7-oxo-1,4-diazepan-1-yl]ethyl-dimethyl-ammonium CAS Name: 2-[4-[3-(ethylcarbamoyl)-2-pyridinyl]-7-oxo-1,4-diazepan-1-yl]ethyl-dimethylammonium IUPAC Name: 2-[4-[3-(ethylcarbamoyl)pyridin-2-yl]-7-oxo-1,4-diazepan-1-yl]ethyl-dimethylazanium Traditional Name: 2-[4-[3-(ethylcarbamoyl)-2-pyridyl]-7-keto-1,4-diazepan-1-yl]ethyl-dimethyl-ammonium Formula: C17H28N5O2+ MolecularWeight: 334.43652

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=C(N=CC=C1)N2CCC(=O)N(CC2)CC[NH+](C)C

Isomeric SMILES

CCNC(=O)C1=C(N=CC=C1)N2CCC(=O)N(CC2)CC[NH+](C)C

InChI

InChI=1S/C17H27N5O2/c1-4-18-17(24)14-6-5-8-19-16(14)22-9-7-15(23)21(12-13-22)11-10-20(2)3/h5-6,8H,4,7,9-13H2,1-3H3,(H,18,24)/p+1