methyl 1-(6-cyano-2,2-dimethyl-chromen-4-yl)indole-3-carboxylate

Systemtic Name: methyl 1-(6-cyano-2,2-dimethyl-chromen-4-yl)indole-3-carboxylate Openeye Name: methyl 1-(6-cyano-2,2-dimethyl-chromen-4-yl)indole-3-carboxylate CAS Name: 1-(6-cyano-2,2-dimethyl-1-benzopyran-4-yl)-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(6-cyano-2,2-dimethylchromen-4-yl)indole-3-carboxylate Traditional Name: 1-(6-cyano-2,2-dimethyl-chromen-4-yl)indole-3-carboxylic acid methyl ester Formula: C22H18N2O3 MolecularWeight: 358.38992

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C2=C(O1)C=CC(=C2)C#N)N3C=C(C4=CC=CC=C43)C(=O)OC)C

Isomeric SMILES

CC1(C=C(C2=C(O1)C=CC(=C2)C#N)N3C=C(C4=CC=CC=C43)C(=O)OC)C

InChI

InChI=1S/C22H18N2O3/c1-22(2)11-19(16-10-14(12-23)8-9-20(16)27-22)24-13-17(21(25)26-3)15-6-4-5-7-18(15)24/h4-11,13H,1-3H3