4-(1,3-benzodioxol-5-ylmethylamino)-1-ethyl-piperidine-4-carbonitrile

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethylamino)-1-ethyl-piperidine-4-carbonitrile Openeye Name: 4-(1,3-benzodioxol-5-ylmethylamino)-1-ethyl-piperidine-4-carbonitrile CAS Name: 4-(1,3-benzodioxol-5-ylmethylamino)-1-ethyl-4-piperidinecarbonitrile IUPAC Name: 4-(1,3-benzodioxol-5-ylmethylamino)-1-ethylpiperidine-4-carbonitrile Traditional Name: 1-ethyl-4-(piperonylamino)isonipecotonitrile Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)(C#N)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCN1CCC(CC1)(C#N)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H21N3O2/c1-2-19-7-5-16(11-17,6-8-19)18-10-13-3-4-14-15(9-13)21-12-20-14/h3-4,9,18H,2,5-8,10,12H2,1H3