(4-dimethylaminophenyl)methyl-[2-[(4-ethoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]-ethyl-azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-[2-[(4-ethoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]-ethyl-azanium Openeye Name: (4-dimethylaminophenyl)methyl-[2-(4-ethoxycarbonylanilino)-2-oxo-ethyl]-ethyl-ammonium CAS Name: (4-dimethylaminophenyl)methyl-[2-(4-ethoxycarbonylanilino)-2-oxoethyl]-ethylammonium IUPAC Name: (4-dimethylaminophenyl)methyl-[2-(4-ethoxycarbonylanilino)-2-oxoethyl]-ethylazanium Traditional Name: [2-(4-carbethoxyanilino)-2-keto-ethyl]-[4-(dimethylamino)benzyl]-ethyl-ammonium Formula: C22H30N3O3+ MolecularWeight: 384.4919

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O3/c1-5-25(15-17-7-13-20(14-8-17)24(3)4)16-21(26)23-19-11-9-18(10-12-19)22(27)28-6-2/h7-14H,5-6,15-16H2,1-4H3,(H,23,26)/p+1