tert-butyl 6'-azanyl-5-bromanyl-5'-cyano-2'-methyl-2-oxidanylidene-spiro[1H-indole-3,4'-pyran]-3'-carboxylate

Systemtic Name: tert-butyl 6'-azanyl-5-bromanyl-5'-cyano-2'-methyl-2-oxidanylidene-spiro[1H-indole-3,4'-pyran]-3'-carboxylate Openeye Name: tert-butyl 6'-amino-5-bromo-5'-cyano-2'-methyl-2-oxo-spiro[indoline-3,4'-pyran]-3'-carboxylate CAS Name: 6'-amino-5-bromo-5'-cyano-2'-methyl-2-oxo-3'-spiro[1H-indole-3,4'-pyran]carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6'-amino-5-bromo-5'-cyano-2'-methyl-2-oxospiro[1H-indole-3,4'-pyran]-3'-carboxylate Traditional Name: 6'-amino-5-bromo-5'-cyano-2-keto-2'-methyl-spiro[indoline-3,4'-pyran]-3'-carboxylic acid tert-butyl ester Formula: C19H18BrN3O4 MolecularWeight: 432.26792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2(C3=C(C=CC(=C3)Br)NC2=O)C(=C(O1)N)C#N)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C2(C3=C(C=CC(=C3)Br)NC2=O)C(=C(O1)N)C#N)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H18BrN3O4/c1-9-14(16(24)27-18(2,3)4)19(12(8-21)15(22)26-9)11-7-10(20)5-6-13(11)23-17(19)25/h5-7H,22H2,1-4H3,(H,23,25)