2-[[5-methyl-2-oxidanylidene-1-(pyridin-4-ylmethyl)acenaphthylen-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[5-methyl-2-oxidanylidene-1-(pyridin-4-ylmethyl)acenaphthylen-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[5-methyl-2-oxo-1-(4-pyridylmethyl)acenaphthylen-1-yl]methyl]benzonitrile CAS Name: 2-[[5-methyl-2-oxo-1-(pyridin-4-ylmethyl)-1-acenaphthylenyl]methyl]benzonitrile IUPAC Name: 2-[[5-methyl-2-oxo-1-(pyridin-4-ylmethyl)acenaphthylen-1-yl]methyl]benzonitrile Traditional Name: 2-[[2-keto-5-methyl-1-(4-pyridylmethyl)acenaphthen-1-yl]methyl]benzonitrile Formula: C27H20N2O MolecularWeight: 388.4605

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC=C3C2=C(C=C1)C(=O)C3(CC4=CC=NC=C4)CC5=CC=CC=C5C#N

Isomeric SMILES

CC1=C2C=CC=C3C2=C(C=C1)C(=O)C3(CC4=CC=NC=C4)CC5=CC=CC=C5C#N

InChI

InChI=1S/C27H20N2O/c1-18-9-10-23-25-22(18)7-4-8-24(25)27(26(23)30,15-19-11-13-29-14-12-19)16-20-5-2-3-6-21(20)17-28/h2-14H,15-16H2,1H3