ethyl 4-[(3S)-1-[3-(dimethylamino)phenyl]carbonylpiperidin-3-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(3S)-1-[3-(dimethylamino)phenyl]carbonylpiperidin-3-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(3S)-1-[3-(dimethylamino)benzoyl]-3-piperidyl]piperazine-1-carboxylate CAS Name: 4-[(3S)-1-[[3-(dimethylamino)phenyl]-oxomethyl]-3-piperidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3S)-1-[3-(dimethylamino)benzoyl]piperidin-3-yl]piperazine-1-carboxylate Traditional Name: 4-[(3S)-1-[3-(dimethylamino)benzoyl]-3-piperidyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H32N4O3 MolecularWeight: 388.50378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2CCCN(C2)C(=O)C3=CC(=CC=C3)N(C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)[C@H]2CCCN(C2)C(=O)C3=CC(=CC=C3)N(C)C

InChI

InChI=1S/C21H32N4O3/c1-4-28-21(27)24-13-11-23(12-14-24)19-9-6-10-25(16-19)20(26)17-7-5-8-18(15-17)22(2)3/h5,7-8,15,19H,4,6,9-14,16H2,1-3H3/t19-/m0/s1