2-(2,4-dichlorophenyl)ethyl-[(3S)-2-oxidanylideneazepan-3-yl]azanium

Systemtic Name: 2-(2,4-dichlorophenyl)ethyl-[(3S)-2-oxidanylideneazepan-3-yl]azanium Openeye Name: 2-(2,4-dichlorophenyl)ethyl-[(3S)-2-oxoazepan-3-yl]ammonium CAS Name: 2-(2,4-dichlorophenyl)ethyl-[(3S)-2-oxo-3-azepanyl]ammonium IUPAC Name: 2-(2,4-dichlorophenyl)ethyl-[(3S)-2-oxoazepan-3-yl]azanium Traditional Name: 2-(2,4-dichlorophenyl)ethyl-[(3S)-2-ketoazepan-3-yl]ammonium Formula: C14H19Cl2N2O+ MolecularWeight: 302.21946

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)[NH2+]CCC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C1CCNC(=O)[C@H](C1)[NH2+]CCC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C14H18Cl2N2O/c15-11-5-4-10(12(16)9-11)6-8-17-13-3-1-2-7-18-14(13)19/h4-5,9,13,17H,1-3,6-8H2,(H,18,19)/p+1/t13-/m0/s1