[(2S)-1-[(4-aminocarbonylphenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-1-[(4-aminocarbonylphenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-[(4-carbamoylphenyl)carbamoyl]-2-methyl-propyl]ammonium CAS Name: [(2S)-1-(4-carbamoylanilino)-3-methyl-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-(4-carbamoylanilino)-3-methyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-[(4-carbamoylphenyl)carbamoyl]-2-methyl-propyl]ammonium Formula: C12H18N3O2+ MolecularWeight: 236.29022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O2/c1-7(2)10(13)12(17)15-9-5-3-8(4-6-9)11(14)16/h3-7,10H,13H2,1-2H3,(H2,14,16)(H,15,17)/p+1/t10-/m0/s1