1-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)indole-3-carbonitrile

Systemtic Name: 1-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)indole-3-carbonitrile Openeye Name: 1-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)indole-3-carbonitrile CAS Name: 1-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-3-indolecarbonitrile IUPAC Name: 1-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)indole-3-carbonitrile Traditional Name: 1-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)indole-3-carbonitrile Formula: C21H17N3O2 MolecularWeight: 343.37858

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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#N)O)C

Isomeric SMILES

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

InChI

InChI=1S/C21H17N3O2/c1-21(2)20(25)19(16-9-13(10-22)7-8-18(16)26-21)24-12-14(11-23)15-5-3-4-6-17(15)24/h3-9,12,19-20,25H,1-2H3