[(2S)-1-[(4-chlorophenyl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S)-1-[(4-chlorophenyl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S)-1-[(4-chlorophenyl)carbamoyl]-3-methyl-butyl]ammonium CAS Name: [(2S)-1-(4-chloroanilino)-4-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S)-1-(4-chloroanilino)-4-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S)-1-[(4-chlorophenyl)carbamoyl]-3-methyl-butyl]ammonium Formula: C12H18ClN2O+ MolecularWeight: 241.73712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC=C(C=C1)Cl)[NH3+]

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC1=CC=C(C=C1)Cl)[NH3+]

InChI

InChI=1S/C12H17ClN2O/c1-8(2)7-11(14)12(16)15-10-5-3-9(13)4-6-10/h3-6,8,11H,7,14H2,1-2H3,(H,15,16)/p+1/t11-/m0/s1