[(S)-(4-methylphenyl)-phenyl-methyl]-[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl]azanium

Systemtic Name: [(S)-(4-methylphenyl)-phenyl-methyl]-[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl]azanium Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl]-[(S)-phenyl(p-tolyl)methyl]ammonium CAS Name: [(S)-(4-methylphenyl)-phenylmethyl]-[2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl]ammonium IUPAC Name: [(S)-(4-methylphenyl)-phenylmethyl]-[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl]azanium Traditional Name: [2-(isopropylcarbamoylamino)-2-keto-ethyl]-[(S)-phenyl(p-tolyl)methyl]ammonium Formula: C20H26N3O2+ MolecularWeight: 340.43934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)[NH2+]CC(=O)NC(=O)NC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C2=CC=CC=C2)[NH2+]CC(=O)NC(=O)NC(C)C

InChI

InChI=1S/C20H25N3O2/c1-14(2)22-20(25)23-18(24)13-21-19(16-7-5-4-6-8-16)17-11-9-15(3)10-12-17/h4-12,14,19,21H,13H2,1-3H3,(H2,22,23,24,25)/p+1/t19-/m0/s1