1-(3-cyanopropyl)-2-oxidanylidene-1-(pyridin-4-ylmethyl)acenaphthylene-3-carbonitrile

Systemtic Name: 1-(3-cyanopropyl)-2-oxidanylidene-1-(pyridin-4-ylmethyl)acenaphthylene-3-carbonitrile Openeye Name: 1-(3-cyanopropyl)-2-oxo-1-(4-pyridylmethyl)acenaphthylene-3-carbonitrile CAS Name: 1-(3-cyanopropyl)-2-oxo-1-(pyridin-4-ylmethyl)-3-acenaphthylenecarbonitrile IUPAC Name: 1-(3-cyanopropyl)-2-oxo-1-(pyridin-4-ylmethyl)acenaphthylene-3-carbonitrile Traditional Name: 1-(3-cyanopropyl)-2-keto-1-(4-pyridylmethyl)acenaphthene-3-carbonitrile Formula: C23H17N3O MolecularWeight: 351.40058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C(C(=O)C3=C(C=C2)C#N)(CCCC#N)CC4=CC=NC=C4

Isomeric SMILES

C1=CC2=C3C(=C1)C(C(=O)C3=C(C=C2)C#N)(CCCC#N)CC4=CC=NC=C4

InChI

InChI=1S/C23H17N3O/c24-11-2-1-10-23(14-16-8-12-26-13-9-16)19-5-3-4-17-6-7-18(15-25)21(20(17)19)22(23)27/h3-9,12-13H,1-2,10,14H2