4-(4-tert-butylphenyl)carbonyl-2,3-dihydro-1H-indene-1-carbonitrile

Systemtic Name: 4-(4-tert-butylphenyl)carbonyl-2,3-dihydro-1H-indene-1-carbonitrile Openeye Name: 4-(4-tert-butylbenzoyl)indane-1-carbonitrile CAS Name: 4-[(4-tert-butylphenyl)-oxomethyl]-2,3-dihydro-1H-indene-1-carbonitrile IUPAC Name: 4-(4-tert-butylbenzoyl)-2,3-dihydro-1H-indene-1-carbonitrile Traditional Name: 4-(4-tert-butylbenzoyl)indane-1-carbonitrile Formula: C21H21NO MolecularWeight: 303.39754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)C2=C3CCC(C3=CC=C2)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)C2=C3CCC(C3=CC=C2)C#N

InChI

InChI=1S/C21H21NO/c1-21(2,3)16-10-7-14(8-11-16)20(23)19-6-4-5-17-15(13-22)9-12-18(17)19/h4-8,10-11,15H,9,12H2,1-3H3