[(2S,3S)-3-methyl-1-oxidanylidene-1-[(2-oxidanylidene-2-phenylazanyl-ethyl)amino]pentan-2-yl]azanium

Systemtic Name: [(2S,3S)-3-methyl-1-oxidanylidene-1-[(2-oxidanylidene-2-phenylazanyl-ethyl)amino]pentan-2-yl]azanium Openeye Name: [(1S,2S)-1-[(2-anilino-2-oxo-ethyl)carbamoyl]-2-methyl-butyl]ammonium CAS Name: [(2S,3S)-1-[(2-anilino-2-oxoethyl)amino]-3-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S,3S)-1-[(2-anilino-2-oxoethyl)amino]-3-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S,2S)-1-[(2-anilino-2-keto-ethyl)carbamoyl]-2-methyl-butyl]ammonium Formula: C14H22N3O2+ MolecularWeight: 264.34338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O2/c1-3-10(2)13(15)14(19)16-9-12(18)17-11-7-5-4-6-8-11/h4-8,10,13H,3,9,15H2,1-2H3,(H,16,19)(H,17,18)/p+1/t10-,13-/m0/s1