N-(1,3-benzodioxol-5-ylmethyl)-4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-4-oxidanylidene-butanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-4-oxidanylidene-butanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(3S,5S)-3,5-dimethyl-1-piperidyl]-4-oxo-butanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(3S,5S)-3,5-dimethyl-1-piperidinyl]-4-oxobutanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-4-oxobutanamide Traditional Name: 4-[(3S,5S)-3,5-dimethylpiperidino]-4-keto-N-piperonyl-butyramide Formula: C19H26N2O4 MolecularWeight: 346.42074

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CCC(=O)NCC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)C(=O)CCC(=O)NCC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C19H26N2O4/c1-13-7-14(2)11-21(10-13)19(23)6-5-18(22)20-9-15-3-4-16-17(8-15)25-12-24-16/h3-4,8,13-14H,5-7,9-12H2,1-2H3,(H,20,22)/t13-,14-/m0/s1