2-[[2-[(3-chlorophenyl)amino]-2-oxidanylidene-ethyl]amino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[2-[(3-chlorophenyl)amino]-2-oxidanylidene-ethyl]amino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[2-(3-chloroanilino)-2-oxo-ethyl]amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[2-(3-chloroanilino)-2-oxoethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[2-(3-chloroanilino)-2-oxoethyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[2-(3-chloroanilino)-2-keto-ethyl]amino]ethyl-diisopropyl-ammonium Formula: C16H27ClN3O+ MolecularWeight: 312.85808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNCC(=O)NC1=CC(=CC=C1)Cl)C(C)C

Isomeric SMILES

CC(C)[NH+](CCNCC(=O)NC1=CC(=CC=C1)Cl)C(C)C

InChI

InChI=1S/C16H26ClN3O/c1-12(2)20(13(3)4)9-8-18-11-16(21)19-15-7-5-6-14(17)10-15/h5-7,10,12-13,18H,8-9,11H2,1-4H3,(H,19,21)/p+1