3-naphthalen-1-yl-3-phenanthren-4-yl-propanenitrile

Systemtic Name: 3-naphthalen-1-yl-3-phenanthren-4-yl-propanenitrile Openeye Name: 3-(1-naphthyl)-3-(4-phenanthryl)propanenitrile CAS Name: 3-(1-naphthalenyl)-3-(4-phenanthrenyl)propanenitrile IUPAC Name: 3-naphthalen-1-yl-3-phenanthren-4-ylpropanenitrile Traditional Name: 3-(1-naphthyl)-3-(4-phenanthryl)propionitrile Formula: C27H19N MolecularWeight: 357.44646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(CC#N)C3=CC=CC4=C3C5=CC=CC=C5C=C4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(CC#N)C3=CC=CC4=C3C5=CC=CC=C5C=C4

InChI

InChI=1S/C27H19N/c28-18-17-25(24-13-5-9-19-7-1-3-11-22(19)24)26-14-6-10-21-16-15-20-8-2-4-12-23(20)27(21)26/h1-16,25H,17H2