[(2S,3S)-1-[(2-chloranyl-5-methoxycarbonyl-phenyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S,3S)-1-[(2-chloranyl-5-methoxycarbonyl-phenyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S,2S)-1-[(2-chloro-5-methoxycarbonyl-phenyl)carbamoyl]-2-methyl-butyl]ammonium CAS Name: [(2S,3S)-1-(2-chloro-5-methoxycarbonylanilino)-3-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S,3S)-1-(2-chloro-5-methoxycarbonylanilino)-3-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S,2S)-1-[(5-carbomethoxy-2-chloro-phenyl)carbamoyl]-2-methyl-butyl]ammonium Formula: C14H20ClN2O3+ MolecularWeight: 299.7732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19ClN2O3/c1-4-8(2)12(16)13(18)17-11-7-9(14(19)20-3)5-6-10(11)15/h5-8,12H,4,16H2,1-3H3,(H,17,18)/p+1/t8-,12-/m0/s1