[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-ethyl-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl]-ethyl-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl]-ethyl-[2-(3-methoxyanilino)-2-oxo-ethyl]ammonium CAS Name: [2-(1-azepanyl)-2-oxoethyl]-ethyl-[2-(3-methoxyanilino)-2-oxoethyl]ammonium IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl]-ethyl-[2-(3-methoxyanilino)-2-oxoethyl]azanium Traditional Name: [2-(azepan-1-yl)-2-keto-ethyl]-ethyl-[2-keto-2-(m-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=C1)OC)CC(=O)N2CCCCCC2

Isomeric SMILES

CC[NH+](CC(=O)NC1=CC(=CC=C1)OC)CC(=O)N2CCCCCC2

InChI

InChI=1S/C19H29N3O3/c1-3-21(15-19(24)22-11-6-4-5-7-12-22)14-18(23)20-16-9-8-10-17(13-16)25-2/h8-10,13H,3-7,11-12,14-15H2,1-2H3,(H,20,23)/p+1