[4-[[2-[[(2S)-butan-2-yl]carbamoyl]phenyl]amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[[2-[[(2S)-butan-2-yl]carbamoyl]phenyl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[2-[[(1S)-1-methylpropyl]carbamoyl]anilino]-4-oxo-butyl]ammonium CAS Name: [4-[2-[[[(2S)-butan-2-yl]amino]-oxomethyl]anilino]-4-oxobutyl]ammonium IUPAC Name: [4-[2-[[(2S)-butan-2-yl]carbamoyl]anilino]-4-oxobutyl]azanium Traditional Name: [4-keto-4-[2-[[(1S)-1-methylpropyl]carbamoyl]anilino]butyl]ammonium Formula: C15H24N3O2+ MolecularWeight: 278.36996

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=CC=C1NC(=O)CCC[NH3+]

Isomeric SMILES

CC[C@H](C)NC(=O)C1=CC=CC=C1NC(=O)CCC[NH3+]

InChI

InChI=1S/C15H23N3O2/c1-3-11(2)17-15(20)12-7-4-5-8-13(12)18-14(19)9-6-10-16/h4-5,7-8,11H,3,6,9-10,16H2,1-2H3,(H,17,20)(H,18,19)/p+1/t11-/m0/s1