[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl]-(diphenylmethyl)-methyl-azanium

Systemtic Name: [2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl]-(diphenylmethyl)-methyl-azanium Openeye Name: benzhydryl-methyl-[2-[[(1S)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl]ammonium CAS Name: [2-[[[[(2S)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl]-(diphenylmethyl)-methylammonium IUPAC Name: benzhydryl-[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxoethyl]-methylazanium Traditional Name: benzhydryl-[2-keto-2-[[(1S)-1-methylpropyl]carbamoylamino]ethyl]-methyl-ammonium Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)C[NH+](C)C(C1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)NC(=O)NC(=O)C[NH+](C)C(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C21H27N3O2/c1-4-16(2)22-21(26)23-19(25)15-24(3)20(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,16,20H,4,15H2,1-3H3,(H2,22,23,25,26)/p+1/t16-/m0/s1