[(2R)-1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl]-[(4-ethylphenyl)methyl]-methyl-azanium

Systemtic Name: [(2R)-1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl]-[(4-ethylphenyl)methyl]-methyl-azanium Openeye Name: [(1R)-2-(4-acetamidoanilino)-1-methyl-2-oxo-ethyl]-[(4-ethylphenyl)methyl]-methyl-ammonium CAS Name: [(2R)-1-(4-acetamidoanilino)-1-oxopropan-2-yl]-[(4-ethylphenyl)methyl]-methylammonium IUPAC Name: [(2R)-1-(4-acetamidoanilino)-1-oxopropan-2-yl]-[(4-ethylphenyl)methyl]-methylazanium Traditional Name: [(1R)-2-(4-acetamidoanilino)-2-keto-1-methyl-ethyl]-(4-ethylbenzyl)-methyl-ammonium Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+](C)C(C)C(=O)NC2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+](C)[C@H](C)C(=O)NC2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C21H27N3O2/c1-5-17-6-8-18(9-7-17)14-24(4)15(2)21(26)23-20-12-10-19(11-13-20)22-16(3)25/h6-13,15H,5,14H2,1-4H3,(H,22,25)(H,23,26)/p+1/t15-/m1/s1