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

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl]-ethyl-[2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl]-ethyl-[2-(2-methoxyanilino)-2-oxo-ethyl]ammonium CAS Name: [2-(1-azepanyl)-2-oxoethyl]-ethyl-[2-(2-methoxyanilino)-2-oxoethyl]ammonium IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl]-ethyl-[2-(2-methoxyanilino)-2-oxoethyl]azanium Traditional Name: [2-(azepan-1-yl)-2-keto-ethyl]-ethyl-[2-keto-2-(o-anisidino)ethyl]ammonium Formula: C19H30N3O3+ MolecularWeight: 348.4598

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(=O)NC1=CC=CC=C1OC)CC(=O)N2CCCCCC2

Isomeric SMILES

CC[NH+](CC(=O)NC1=CC=CC=C1OC)CC(=O)N2CCCCCC2

InChI

InChI=1S/C19H29N3O3/c1-3-21(15-19(24)22-12-8-4-5-9-13-22)14-18(23)20-16-10-6-7-11-17(16)25-2/h6-7,10-11H,3-5,8-9,12-15H2,1-2H3,(H,20,23)/p+1