methyl 2-azanyl-3-cyano-7a-methyl-5-oxidanylidene-1-phenethyl-indole-7-carboxylate

Systemtic Name: methyl 2-azanyl-3-cyano-7a-methyl-5-oxidanylidene-1-phenethyl-indole-7-carboxylate Openeye Name: methyl 2-amino-3-cyano-7a-methyl-5-oxo-1-phenethyl-indole-7-carboxylate CAS Name: 2-amino-3-cyano-7a-methyl-5-oxo-1-phenethyl-7-indolecarboxylic acid methyl ester IUPAC Name: methyl 2-amino-3-cyano-7a-methyl-5-oxo-1-phenethylindole-7-carboxylate Traditional Name: 2-amino-3-cyano-5-keto-7a-methyl-1-phenethyl-indole-7-carboxylic acid methyl ester Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

CC12C(=CC(=O)C=C1C(=O)OC)C(=C(N2CCC3=CC=CC=C3)N)C#N

Isomeric SMILES

CC12C(=CC(=O)C=C1C(=O)OC)C(=C(N2CCC3=CC=CC=C3)N)C#N

InChI

InChI=1S/C20H19N3O3/c1-20-16(10-14(24)11-17(20)19(25)26-2)15(12-21)18(22)23(20)9-8-13-6-4-3-5-7-13/h3-7,10-11H,8-9,22H2,1-2H3