ethyl (3S)-6'-azanyl-5'-cyano-2',5-dimethyl-2-oxidanylidene-spiro[1H-indole-3,4'-pyran]-3'-carboxylate

Systemtic Name: ethyl (3S)-6'-azanyl-5'-cyano-2',5-dimethyl-2-oxidanylidene-spiro[1H-indole-3,4'-pyran]-3'-carboxylate Openeye Name: ethyl (3S)-6'-amino-5'-cyano-2',5-dimethyl-2-oxo-spiro[indoline-3,4'-pyran]-3'-carboxylate CAS Name: (3S)-6'-amino-5'-cyano-2',5-dimethyl-2-oxo-3'-spiro[1H-indole-3,4'-pyran]carboxylic acid ethyl ester IUPAC Name: ethyl (3S)-6'-amino-5'-cyano-2',5-dimethyl-2-oxospiro[1H-indole-3,4'-pyran]-3'-carboxylate Traditional Name: (3S)-6'-amino-5'-cyano-2-keto-2',5-dimethyl-spiro[indoline-3,4'-pyran]-3'-carboxylic acid ethyl ester Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C1=C(OC(=C([C@@]12C3=C(C=CC(=C3)C)NC2=O)C#N)N)C

InChI

InChI=1S/C18H17N3O4/c1-4-24-16(22)14-10(3)25-15(20)12(8-19)18(14)11-7-9(2)5-6-13(11)21-17(18)23/h5-7H,4,20H2,1-3H3,(H,21,23)/t18-/m0/s1