[3-[(2-azanyl-5-chloranyl-phenyl)amino]-3-oxidanylidene-propyl]-methyl-propan-2-yl-azanium

Systemtic Name: [3-[(2-azanyl-5-chloranyl-phenyl)amino]-3-oxidanylidene-propyl]-methyl-propan-2-yl-azanium Openeye Name: [3-(2-amino-5-chloro-anilino)-3-oxo-propyl]-isopropyl-methyl-ammonium CAS Name: [3-(2-amino-5-chloroanilino)-3-oxopropyl]-methyl-propan-2-ylammonium IUPAC Name: [3-(2-amino-5-chloroanilino)-3-oxopropyl]-methyl-propan-2-ylazanium Traditional Name: [3-(2-amino-5-chloro-anilino)-3-keto-propyl]-isopropyl-methyl-ammonium Formula: C13H21ClN3O+ MolecularWeight: 270.77834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20ClN3O/c1-9(2)17(3)7-6-13(18)16-12-8-10(14)4-5-11(12)15/h4-5,8-9H,6-7,15H2,1-3H3,(H,16,18)/p+1