4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 1-cyclopropyl-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 1-cyclopropyl-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)butyl 1-cyclopropyl-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-cyclopropyl-2,5-dimethyl-3-pyrrolecarboxylic acid 4-(1,3-dioxo-2-isoindolyl)butyl ester IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)butyl 1-cyclopropyl-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-cyclopropyl-2,5-dimethyl-pyrrole-3-carboxylic acid 4-phthalimidobutyl ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C(=O)OCCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)C(=O)OCCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H24N2O4/c1-14-13-19(15(2)24(14)16-9-10-16)22(27)28-12-6-5-11-23-20(25)17-7-3-4-8-18(17)21(23)26/h3-4,7-8,13,16H,5-6,9-12H2,1-2H3