N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-[1-(2-oxidanylidene-2-piperidin-1-yl-ethyl)indol-3-yl]prop-2-enamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-[1-(2-oxidanylidene-2-piperidin-1-yl-ethyl)indol-3-yl]prop-2-enamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-[1-[2-oxo-2-(1-piperidyl)ethyl]indol-3-yl]prop-2-enamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-[1-[2-oxo-2-(1-piperidinyl)ethyl]-3-indolyl]-2-propenamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-[1-(2-oxo-2-piperidin-1-ylethyl)indol-3-yl]prop-2-enamide Traditional Name: 2-cyano-3-[1-(2-keto-2-piperidino-ethyl)indol-3-yl]-N-piperonyl-acrylamide Formula: C27H26N4O4 MolecularWeight: 470.51974

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CN2C=C(C3=CC=CC=C32)C=C(C#N)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCN(CC1)C(=O)CN2C=C(C3=CC=CC=C32)C=C(C#N)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H26N4O4/c28-14-20(27(33)29-15-19-8-9-24-25(12-19)35-18-34-24)13-21-16-31(23-7-3-2-6-22(21)23)17-26(32)30-10-4-1-5-11-30/h2-3,6-9,12-13,16H,1,4-5,10-11,15,17-18H2,(H,29,33)