3-azanyl-4-[[(Z)-5-(1,3-benzodioxol-5-yl)-5-oxidanyl-1-oxidanylidene-1-piperidin-1-yl-pent-3-en-2-yl]amino]-N-(2-hydroxyethyl)benzamide

Systemtic Name: 3-azanyl-4-[[(Z)-5-(1,3-benzodioxol-5-yl)-5-oxidanyl-1-oxidanylidene-1-piperidin-1-yl-pent-3-en-2-yl]amino]-N-(2-hydroxyethyl)benzamide Openeye Name: 3-amino-4-[[(Z)-4-(1,3-benzodioxol-5-yl)-4-hydroxy-1-(piperidine-1-carbonyl)but-2-enyl]amino]-N-(2-hydroxyethyl)benzamide CAS Name: 3-amino-4-[[(Z)-5-(1,3-benzodioxol-5-yl)-5-hydroxy-1-oxo-1-(1-piperidinyl)pent-3-en-2-yl]amino]-N-(2-hydroxyethyl)benzamide IUPAC Name: 3-amino-4-[[(Z)-5-(1,3-benzodioxol-5-yl)-5-hydroxy-1-oxo-1-piperidin-1-ylpent-3-en-2-yl]amino]-N-(2-hydroxyethyl)benzamide Traditional Name: 3-amino-4-[[(Z)-4-(1,3-benzodioxol-5-yl)-4-hydroxy-1-(piperidine-1-carbonyl)but-2-enyl]amino]-N-(2-hydroxyethyl)benzamide Formula: C26H32N4O6 MolecularWeight: 496.55548

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(C=CC(C2=CC3=C(C=C2)OCO3)O)NC4=C(C=C(C=C4)C(=O)NCCO)N

Isomeric SMILES

C1CCN(CC1)C(=O)C(/C=C\C(C2=CC3=C(C=C2)OCO3)O)NC4=C(C=C(C=C4)C(=O)NCCO)N

InChI

InChI=1S/C26H32N4O6/c27-19-14-18(25(33)28-10-13-31)4-6-20(19)29-21(26(34)30-11-2-1-3-12-30)7-8-22(32)17-5-9-23-24(15-17)36-16-35-23/h4-9,14-15,21-22,29,31-32H,1-3,10-13,16,27H2,(H,28,33)/b8-7-