2-hydroxyethyl (4E)-4-(1,3-benzodioxol-5-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: 2-hydroxyethyl (4E)-4-(1,3-benzodioxol-5-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: 2-hydroxyethyl (4E)-4-(1,3-benzodioxol-5-ylmethylene)-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (4E)-4-(1,3-benzodioxol-5-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl (4E)-4-(1,3-benzodioxol-5-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (4E)-4-piperonylidene-2,3-dihydro-1H-acridine-9-carboxylic acid 2-hydroxyethyl ester Formula: C24H21NO5 MolecularWeight: 403.42724

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CC3=C(C=C2)OCO3)C4=NC5=CC=CC=C5C(=C4C1)C(=O)OCCO

Isomeric SMILES

C1C/C(=C\C2=CC3=C(C=C2)OCO3)/C4=NC5=CC=CC=C5C(=C4C1)C(=O)OCCO

InChI

InChI=1S/C24H21NO5/c26-10-11-28-24(27)22-17-5-1-2-7-19(17)25-23-16(4-3-6-18(22)23)12-15-8-9-20-21(13-15)30-14-29-20/h1-2,5,7-9,12-13,26H,3-4,6,10-11,14H2/b16-12+