5-(3,3-dimethyl-1-oxidanyl-1,2-dihydroinden-5-yl)-1-methyl-pyrrole-2-carbonitrile

Systemtic Name: 5-(3,3-dimethyl-1-oxidanyl-1,2-dihydroinden-5-yl)-1-methyl-pyrrole-2-carbonitrile Openeye Name: 5-(1-hydroxy-3,3-dimethyl-indan-5-yl)-1-methyl-pyrrole-2-carbonitrile CAS Name: 5-(1-hydroxy-3,3-dimethyl-1,2-dihydroinden-5-yl)-1-methyl-2-pyrrolecarbonitrile IUPAC Name: 5-(1-hydroxy-3,3-dimethyl-1,2-dihydroinden-5-yl)-1-methylpyrrole-2-carbonitrile Traditional Name: 5-(1-hydroxy-3,3-dimethyl-indan-5-yl)-1-methyl-pyrrole-2-carbonitrile Formula: C17H18N2O MolecularWeight: 266.33762

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C1C=C(C=C2)C3=CC=C(N3C)C#N)O)C

Isomeric SMILES

CC1(CC(C2=C1C=C(C=C2)C3=CC=C(N3C)C#N)O)C

InChI

InChI=1S/C17H18N2O/c1-17(2)9-16(20)13-6-4-11(8-14(13)17)15-7-5-12(10-18)19(15)3/h4-8,16,20H,9H2,1-3H3