(3S)-N-(1,3-benzodioxol-5-yl)-3-[ethyl(pyridin-4-ylmethyl)amino]piperidine-1-carboxamide

Systemtic Name: (3S)-N-(1,3-benzodioxol-5-yl)-3-[ethyl(pyridin-4-ylmethyl)amino]piperidine-1-carboxamide Openeye Name: (3S)-N-(1,3-benzodioxol-5-yl)-3-[ethyl(4-pyridylmethyl)amino]piperidine-1-carboxamide CAS Name: (3S)-N-(1,3-benzodioxol-5-yl)-3-[ethyl(pyridin-4-ylmethyl)amino]-1-piperidinecarboxamide IUPAC Name: (3S)-N-(1,3-benzodioxol-5-yl)-3-[ethyl(pyridin-4-ylmethyl)amino]piperidine-1-carboxamide Traditional Name: (3S)-N-(1,3-benzodioxol-5-yl)-3-[ethyl(4-pyridylmethyl)amino]piperidine-1-carboxamide Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=NC=C1)C2CCCN(C2)C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCN(CC1=CC=NC=C1)[C@H]2CCCN(C2)C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H26N4O3/c1-2-24(13-16-7-9-22-10-8-16)18-4-3-11-25(14-18)21(26)23-17-5-6-19-20(12-17)28-15-27-19/h5-10,12,18H,2-4,11,13-15H2,1H3,(H,23,26)/t18-/m0/s1