[3-[(3-azanyl-4-chloranyl-phenyl)amino]-3-oxidanylidene-propyl]-cyclohexyl-methyl-azanium

Systemtic Name: [3-[(3-azanyl-4-chloranyl-phenyl)amino]-3-oxidanylidene-propyl]-cyclohexyl-methyl-azanium Openeye Name: [3-(3-amino-4-chloro-anilino)-3-oxo-propyl]-cyclohexyl-methyl-ammonium CAS Name: [3-(3-amino-4-chloroanilino)-3-oxopropyl]-cyclohexyl-methylammonium IUPAC Name: [3-(3-amino-4-chloroanilino)-3-oxopropyl]-cyclohexyl-methylazanium Traditional Name: [3-(3-amino-4-chloro-anilino)-3-keto-propyl]-cyclohexyl-methyl-ammonium Formula: C16H25ClN3O+ MolecularWeight: 310.8422

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC(=O)NC1=CC(=C(C=C1)Cl)N)C2CCCCC2

Isomeric SMILES

C[NH+](CCC(=O)NC1=CC(=C(C=C1)Cl)N)C2CCCCC2

InChI

InChI=1S/C16H24ClN3O/c1-20(13-5-3-2-4-6-13)10-9-16(21)19-12-7-8-14(17)15(18)11-12/h7-8,11,13H,2-6,9-10,18H2,1H3,(H,19,21)/p+1