[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-[2-(4-methoxyphenyl)ethyl]azanium

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl]-[2-(4-methoxyphenyl)ethyl]azanium Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl]-[2-(4-methoxyphenyl)ethyl]ammonium CAS Name: [2-(1-azepanyl)-2-oxoethyl]-[2-(4-methoxyphenyl)ethyl]ammonium IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl]-[2-(4-methoxyphenyl)ethyl]azanium Traditional Name: [2-(azepan-1-yl)-2-keto-ethyl]-[2-(4-methoxyphenyl)ethyl]ammonium Formula: C17H27N2O2+ MolecularWeight: 291.40848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC[NH2+]CC(=O)N2CCCCCC2

Isomeric SMILES

COC1=CC=C(C=C1)CC[NH2+]CC(=O)N2CCCCCC2

InChI

InChI=1S/C17H26N2O2/c1-21-16-8-6-15(7-9-16)10-11-18-14-17(20)19-12-4-2-3-5-13-19/h6-9,18H,2-5,10-14H2,1H3/p+1