methyl-[(1R)-2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]-[(4-propan-2-ylphenyl)methyl]azanium

Systemtic Name: methyl-[(1R)-2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: (4-isopropylphenyl)methyl-methyl-[(1R)-2-(methylcarbamoylamino)-2-oxo-1-phenyl-ethyl]ammonium CAS Name: methyl-[(1R)-2-(methylcarbamoylamino)-2-oxo-1-phenylethyl]-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: methyl-[(1R)-2-(methylcarbamoylamino)-2-oxo-1-phenylethyl]-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: (4-isopropylbenzyl)-[(1R)-2-keto-2-(methylcarbamoylamino)-1-phenyl-ethyl]-methyl-ammonium Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O2/c1-15(2)17-12-10-16(11-13-17)14-24(4)19(18-8-6-5-7-9-18)20(25)23-21(26)22-3/h5-13,15,19H,14H2,1-4H3,(H2,22,23,25,26)/p+1/t19-/m1/s1