9-methylanthracene; 4-(phenylcarbonyl)benzenecarbonitrile

Systemtic Name: 9-methylanthracene; 4-(phenylcarbonyl)benzenecarbonitrile Openeye Name: 4-benzoylbenzonitrile; 9-methylanthracene CAS Name: 4-benzoylbenzonitrile; 9-methylanthracene IUPAC Name: 4-benzoylbenzonitrile; 9-methylanthracene Traditional Name: 4-benzoylbenzonitrile; 9-methylanthracene Formula: C29H21NO MolecularWeight: 399.48314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC=CC2=CC3=CC=CC=C13.C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=C2C=CC=CC2=CC3=CC=CC=C13.C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C15H12.C14H9NO/c1-11-14-8-4-2-6-12(14)10-13-7-3-5-9-15(11)13;15-10-11-6-8-13(9-7-11)14(16)12-4-2-1-3-5-12/h2-10H,1H3;1-9H