[(2R)-1-[(4-aminocarbonylphenyl)amino]-1-oxidanylidene-propan-2-yl]-[(4-dimethylaminophenyl)methyl]-ethyl-azanium

Systemtic Name: [(2R)-1-[(4-aminocarbonylphenyl)amino]-1-oxidanylidene-propan-2-yl]-[(4-dimethylaminophenyl)methyl]-ethyl-azanium Openeye Name: [(1R)-2-(4-carbamoylanilino)-1-methyl-2-oxo-ethyl]-[(4-dimethylaminophenyl)methyl]-ethyl-ammonium CAS Name: [(2R)-1-(4-carbamoylanilino)-1-oxopropan-2-yl]-[(4-dimethylaminophenyl)methyl]-ethylammonium IUPAC Name: [(2R)-1-(4-carbamoylanilino)-1-oxopropan-2-yl]-[(4-dimethylaminophenyl)methyl]-ethylazanium Traditional Name: [(1R)-2-(4-carbamoylanilino)-2-keto-1-methyl-ethyl]-[4-(dimethylamino)benzyl]-ethyl-ammonium Formula: C21H29N4O2+ MolecularWeight: 369.48056

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=C(C=C1)N(C)C)C(C)C(=O)NC2=CC=C(C=C2)C(=O)N

Isomeric SMILES

CC[NH+](CC1=CC=C(C=C1)N(C)C)[C@H](C)C(=O)NC2=CC=C(C=C2)C(=O)N

InChI

InChI=1S/C21H28N4O2/c1-5-25(14-16-6-12-19(13-7-16)24(3)4)15(2)21(27)23-18-10-8-17(9-11-18)20(22)26/h6-13,15H,5,14H2,1-4H3,(H2,22,26)(H,23,27)/p+1/t15-/m1/s1