ethyl 4-[2-[(4-dimethylaminophenyl)methyl-ethyl-amino]ethanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(4-dimethylaminophenyl)methyl-ethyl-amino]ethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[(4-dimethylaminophenyl)methyl-ethyl-amino]acetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-[(4-dimethylaminophenyl)methyl-ethylamino]-1-oxoethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(4-dimethylaminophenyl)methyl-ethylamino]acetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-[[4-(dimethylamino)benzyl]-ethyl-amino]acetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C21H34N4O3 MolecularWeight: 390.51966

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(C=C1)N(C)C)CC(=O)NC2CCN(CC2)C(=O)OCC

Isomeric SMILES

CCN(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)