6-[3-methyl-1-oxidanyl-1-[1-(triphenylmethyl)imidazol-4-yl]butyl]naphthalene-2-carbonitrile

Systemtic Name: 6-[3-methyl-1-oxidanyl-1-[1-(triphenylmethyl)imidazol-4-yl]butyl]naphthalene-2-carbonitrile Openeye Name: 6-[1-hydroxy-3-methyl-1-(1-tritylimidazol-4-yl)butyl]naphthalene-2-carbonitrile CAS Name: 6-[1-hydroxy-3-methyl-1-[1-(triphenylmethyl)-4-imidazolyl]butyl]-2-naphthalenecarbonitrile IUPAC Name: 6-[1-hydroxy-3-methyl-1-(1-tritylimidazol-4-yl)butyl]naphthalene-2-carbonitrile Traditional Name: 6-[1-hydroxy-3-methyl-1-(1-tritylimidazol-4-yl)butyl]naphthalene-2-carbonitrile Formula: C38H33N3O MolecularWeight: 547.68812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC2=C(C=C1)C=C(C=C2)C#N)(C3=CN(C=N3)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)O

Isomeric SMILES

CC(C)CC(C1=CC2=C(C=C1)C=C(C=C2)C#N)(C3=CN(C=N3)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)O

InChI

InChI=1S/C38H33N3O/c1-28(2)24-37(42,35-21-20-30-22-29(25-39)18-19-31(30)23-35)36-26-41(27-40-36)38(32-12-6-3-7-13-32,33-14-8-4-9-15-33)34-16-10-5-11-17-34/h3-23,26-28,42H,24H2,1-2H3