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

Systemtic Name: methyl 3-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]-7-propan-2-yl-azulene-1-carboxylate Openeye Name: methyl 3-[2-(1,3-dioxoisoindolin-2-yl)ethyl]-7-isopropyl-azulene-1-carboxylate CAS Name: 3-[2-(1,3-dioxo-2-isoindolyl)ethyl]-7-propan-2-yl-1-azulenecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-(1,3-dioxoisoindol-2-yl)ethyl]-7-propan-2-ylazulene-1-carboxylate Traditional Name: 7-isopropyl-3-(2-phthalimidoethyl)azulene-1-carboxylic acid methyl ester Formula: C25H23NO4 MolecularWeight: 401.45442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC2=C(C=C(C2=C1)C(=O)OC)CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)C1=CC=CC2=C(C=C(C2=C1)C(=O)OC)CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C25H23NO4/c1-15(2)16-7-6-10-18-17(14-22(21(18)13-16)25(29)30-3)11-12-26-23(27)19-8-4-5-9-20(19)24(26)28/h4-10,13-15H,11-12H2,1-3H3