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

Systemtic Name: ethyl 6'-azanyl-6-bromanyl-5'-cyano-2'-methyl-2-oxidanylidene-spiro[1H-indole-3,4'-pyran]-3'-carboxylate Openeye Name: ethyl 6'-amino-6-bromo-5'-cyano-2'-methyl-2-oxo-spiro[indoline-3,4'-pyran]-3'-carboxylate CAS Name: 6'-amino-6-bromo-5'-cyano-2'-methyl-2-oxo-3'-spiro[1H-indole-3,4'-pyran]carboxylic acid ethyl ester IUPAC Name: ethyl 6'-amino-6-bromo-5'-cyano-2'-methyl-2-oxospiro[1H-indole-3,4'-pyran]-3'-carboxylate Traditional Name: 6'-amino-6-bromo-5'-cyano-2-keto-2'-methyl-spiro[indoline-3,4'-pyran]-3'-carboxylic acid ethyl ester Formula: C17H14BrN3O4 MolecularWeight: 404.21476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C12C3=C(C=C(C=C3)Br)NC2=O)C#N)N)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C12C3=C(C=C(C=C3)Br)NC2=O)C#N)N)C

InChI

InChI=1S/C17H14BrN3O4/c1-3-24-15(22)13-8(2)25-14(20)11(7-19)17(13)10-5-4-9(18)6-12(10)21-16(17)23/h4-6H,3,20H2,1-2H3,(H,21,23)