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

Systemtic Name: ethyl 6'-azanyl-5-bromanyl-5'-cyano-2-oxidanylidene-2'-phenyl-spiro[1H-indole-3,4'-pyran]-3'-carboxylate Openeye Name: ethyl 6'-amino-5-bromo-5'-cyano-2-oxo-2'-phenyl-spiro[indoline-3,4'-pyran]-3'-carboxylate CAS Name: 6'-amino-5-bromo-5'-cyano-2-oxo-2'-phenyl-3'-spiro[1H-indole-3,4'-pyran]carboxylic acid ethyl ester IUPAC Name: ethyl 6'-amino-5-bromo-5'-cyano-2-oxo-2'-phenylspiro[1H-indole-3,4'-pyran]-3'-carboxylate Traditional Name: 6'-amino-5-bromo-5'-cyano-2-keto-2'-phenyl-spiro[indoline-3,4'-pyran]-3'-carboxylic acid ethyl ester Formula: C22H16BrN3O4 MolecularWeight: 466.28414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C12C3=C(C=CC(=C3)Br)NC2=O)C#N)N)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C12C3=C(C=CC(=C3)Br)NC2=O)C#N)N)C4=CC=CC=C4

InChI

InChI=1S/C22H16BrN3O4/c1-2-29-20(27)17-18(12-6-4-3-5-7-12)30-19(25)15(11-24)22(17)14-10-13(23)8-9-16(14)26-21(22)28/h3-10H,2,25H2,1H3,(H,26,28)