methyl 3-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propyl]-7-propan-2-yl-azulene-1-carboxylate

Systemtic Name: methyl 3-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propyl]-7-propan-2-yl-azulene-1-carboxylate Openeye Name: methyl 3-[3-(1,3-dioxoisoindolin-2-yl)propyl]-7-isopropyl-azulene-1-carboxylate CAS Name: 3-[3-(1,3-dioxo-2-isoindolyl)propyl]-7-propan-2-yl-1-azulenecarboxylic acid methyl ester IUPAC Name: methyl 3-[3-(1,3-dioxoisoindol-2-yl)propyl]-7-propan-2-ylazulene-1-carboxylate Traditional Name: 7-isopropyl-3-(3-phthalimidopropyl)azulene-1-carboxylic acid methyl ester Formula: C26H25NO4 MolecularWeight: 415.481

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC2=C(C=C(C2=C1)C(=O)OC)CCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)C1=CC=CC2=C(C=C(C2=C1)C(=O)OC)CCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C26H25NO4/c1-16(2)17-8-6-12-19-18(15-23(22(19)14-17)26(30)31-3)9-7-13-27-24(28)20-10-4-5-11-21(20)25(27)29/h4-6,8,10-12,14-16H,7,9,13H2,1-3H3