[1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl] 4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: [1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl] 4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: [2-(cyclopentylamino)-1-methyl-2-oxo-ethyl] 4-[(3-nitrophenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: 4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid [1-(cyclopentylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclopentylamino)-1-oxopropan-2-yl] 4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: 4-(3-nitrobenzylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid [2-(cyclopentylamino)-2-keto-1-methyl-ethyl] ester Formula: C29H29N3O5 MolecularWeight: 499.55766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)OC(=O)C2=C3CCCC(=CC4=CC(=CC=C4)[N+](=O)[O-])C3=NC5=CC=CC=C52

Isomeric SMILES

CC(C(=O)NC1CCCC1)OC(=O)C2=C3CCCC(=CC4=CC(=CC=C4)[N+](=O)[O-])C3=NC5=CC=CC=C52

InChI

InChI=1S/C29H29N3O5/c1-18(28(33)30-21-10-2-3-11-21)37-29(34)26-23-13-4-5-15-25(23)31-27-20(9-7-14-24(26)27)16-19-8-6-12-22(17-19)32(35)36/h4-6,8,12-13,15-18,21H,2-3,7,9-11,14H2,1H3,(H,30,33)