ethyl 4-[2-[(4-dimethylaminophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]piperazin-4-ium-1-carboxylate

Systemtic Name: ethyl 4-[2-[(4-dimethylaminophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]piperazin-4-ium-1-carboxylate Openeye Name: ethyl 4-[2-[(4-dimethylaminophenyl)methyl-methyl-amino]-2-oxo-ethyl]piperazin-4-ium-1-carboxylate CAS Name: 4-[2-[(4-dimethylaminophenyl)methyl-methylamino]-2-oxoethyl]-1-piperazin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-dimethylaminophenyl)methyl-methylamino]-2-oxoethyl]piperazin-4-ium-1-carboxylate Traditional Name: 4-[2-[[4-(dimethylamino)benzyl]-methyl-amino]-2-keto-ethyl]piperazin-4-ium-1-carboxylic acid ethyl ester Formula: C19H31N4O3+ MolecularWeight: 363.47444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CC[NH+](CC1)CC(=O)N(C)CC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CCOC(=O)N1CC[NH+](CC1)CC(=O)N(C)CC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C19H30N4O3/c1-5-26-19(25)23-12-10-22(11-13-23)15-18(24)21(4)14-16-6-8-17(9-7-16)20(2)3/h6-9H,5,10-15H2,1-4H3/p+1