ethyl 5-chloranyl-1-methyl-3-[(1R)-3-oxidanylidene-2-(3-propan-2-yloxypropyl)-1H-isoindol-1-yl]indole-2-carboxylate

Systemtic Name: ethyl 5-chloranyl-1-methyl-3-[(1R)-3-oxidanylidene-2-(3-propan-2-yloxypropyl)-1H-isoindol-1-yl]indole-2-carboxylate Openeye Name: ethyl 5-chloro-3-[(1R)-2-(3-isopropoxypropyl)-3-oxo-isoindolin-1-yl]-1-methyl-indole-2-carboxylate CAS Name: 5-chloro-1-methyl-3-[(1R)-3-oxo-2-(3-propan-2-yloxypropyl)-1H-isoindol-1-yl]-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-1-methyl-3-[(1R)-3-oxo-2-(3-propan-2-yloxypropyl)-1H-isoindol-1-yl]indole-2-carboxylate Traditional Name: 5-chloro-3-[(1R)-2-(3-isopropoxypropyl)-3-keto-isoindolin-1-yl]-1-methyl-indole-2-carboxylic acid ethyl ester Formula: C26H29ClN2O4 MolecularWeight: 468.97246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1C)C=CC(=C2)Cl)C3C4=CC=CC=C4C(=O)N3CCCOC(C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1C)C=CC(=C2)Cl)[C@H]3C4=CC=CC=C4C(=O)N3CCCOC(C)C

InChI

InChI=1S/C26H29ClN2O4/c1-5-32-26(31)24-22(20-15-17(27)11-12-21(20)28(24)4)23-18-9-6-7-10-19(18)25(30)29(23)13-8-14-33-16(2)3/h6-7,9-12,15-16,23H,5,8,13-14H2,1-4H3/t23-/m1/s1