tert-butyl 3-[4-chloranyl-2,5-bis(oxidanylidene)-1-phenyl-pyrrol-3-yl]indole-1-carboxylate

Systemtic Name: tert-butyl 3-[4-chloranyl-2,5-bis(oxidanylidene)-1-phenyl-pyrrol-3-yl]indole-1-carboxylate Openeye Name: tert-butyl 3-(4-chloro-2,5-dioxo-1-phenyl-pyrrol-3-yl)indole-1-carboxylate CAS Name: 3-(4-chloro-2,5-dioxo-1-phenyl-3-pyrrolyl)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(4-chloro-2,5-dioxo-1-phenylpyrrol-3-yl)indole-1-carboxylate Traditional Name: 3-(4-chloro-2,5-diketo-1-phenyl-3-pyrrolin-3-yl)indole-1-carboxylic acid tert-butyl ester Formula: C23H19ClN2O4 MolecularWeight: 422.86096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C3=C(C(=O)N(C3=O)C4=CC=CC=C4)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C3=C(C(=O)N(C3=O)C4=CC=CC=C4)Cl

InChI

InChI=1S/C23H19ClN2O4/c1-23(2,3)30-22(29)25-13-16(15-11-7-8-12-17(15)25)18-19(24)21(28)26(20(18)27)14-9-5-4-6-10-14/h4-13H,1-3H3