(5-ethanoyl-2-methoxy-phenyl)methyl 4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 4-(2-thienylmethylene)-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: 4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: 4-(2-thenylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid (5-acetyl-2-methoxy-benzyl) ester Formula: C29H25NO4S MolecularWeight: 483.5781

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)COC(=O)C2=C3CCCC(=CC4=CC=CS4)C3=NC5=CC=CC=C52

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)COC(=O)C2=C3CCCC(=CC4=CC=CS4)C3=NC5=CC=CC=C52

InChI

InChI=1S/C29H25NO4S/c1-18(31)19-12-13-26(33-2)21(15-19)17-34-29(32)27-23-9-3-4-11-25(23)30-28-20(7-5-10-24(27)28)16-22-8-6-14-35-22/h3-4,6,8-9,11-16H,5,7,10,17H2,1-2H3