(4-dimethylaminophenyl)methyl-[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxidanylidene-ethyl]-ethyl-azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxidanylidene-ethyl]-ethyl-azanium Openeye Name: (4-dimethylaminophenyl)methyl-[2-[(1-ethoxycarbonyl-4-piperidyl)amino]-2-oxo-ethyl]-ethyl-ammonium CAS Name: (4-dimethylaminophenyl)methyl-[2-[(1-ethoxycarbonyl-4-piperidinyl)amino]-2-oxoethyl]-ethylammonium IUPAC Name: (4-dimethylaminophenyl)methyl-[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxoethyl]-ethylazanium Traditional Name: [2-[(1-carbethoxy-4-piperidyl)amino]-2-keto-ethyl]-[4-(dimethylamino)benzyl]-ethyl-ammonium Formula: C21H35N4O3+ MolecularWeight: 391.5276

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=C(C=C1)N(C)C)CC(=O)NC2CCN(CC2)C(=O)OCC

Isomeric SMILES

CC[NH+](CC1=CC=C(C=C1)N(C)C)CC(=O)NC2CCN(CC2)C(=O)OCC

InChI

InChI=1S/C21H34N4O3/c1-5-24(15-17-7-9-19(10-8-17)23(3)4)16-20(26)22-18-11-13-25(14-12-18)21(27)28-6-2/h7-10,18H,5-6,11-16H2,1-4H3,(H,22,26)/p+1