[(2S)-1-[(3-chloranyl-4-methoxy-phenyl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S)-1-[(3-chloranyl-4-methoxy-phenyl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S)-1-[(3-chloro-4-methoxy-phenyl)carbamoyl]-3-methyl-butyl]ammonium CAS Name: [(2S)-1-(3-chloro-4-methoxyanilino)-4-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S)-1-(3-chloro-4-methoxyanilino)-4-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S)-1-[(3-chloro-4-methoxy-phenyl)carbamoyl]-3-methyl-butyl]ammonium Formula: C13H20ClN2O2+ MolecularWeight: 271.7631

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19ClN2O2/c1-8(2)6-11(15)13(17)16-9-4-5-12(18-3)10(14)7-9/h4-5,7-8,11H,6,15H2,1-3H3,(H,16,17)/p+1/t11-/m0/s1