4-[1,3-benzodioxol-5-ylmethyl(piperidin-4-yl)amino]-2-oxidanylidene-chromene-6-carbonitrile

Systemtic Name: 4-[1,3-benzodioxol-5-ylmethyl(piperidin-4-yl)amino]-2-oxidanylidene-chromene-6-carbonitrile Openeye Name: 4-[1,3-benzodioxol-5-ylmethyl(4-piperidyl)amino]-2-oxo-chromene-6-carbonitrile CAS Name: 4-[1,3-benzodioxol-5-ylmethyl(4-piperidinyl)amino]-2-oxo-1-benzopyran-6-carbonitrile IUPAC Name: 4-[1,3-benzodioxol-5-ylmethyl(piperidin-4-yl)amino]-2-oxochromene-6-carbonitrile Traditional Name: 2-keto-4-[4-piperidyl(piperonyl)amino]chromene-6-carbonitrile Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N(CC2=CC3=C(C=C2)OCO3)C4=CC(=O)OC5=C4C=C(C=C5)C#N

Isomeric SMILES

C1CNCCC1N(CC2=CC3=C(C=C2)OCO3)C4=CC(=O)OC5=C4C=C(C=C5)C#N

InChI

InChI=1S/C23H21N3O4/c24-12-15-1-3-20-18(9-15)19(11-23(27)30-20)26(17-5-7-25-8-6-17)13-16-2-4-21-22(10-16)29-14-28-21/h1-4,9-11,17,25H,5-8,13-14H2