2-(2-heptoxyethyl)-3,4-diphenyl-benzenecarbonitrile

Systemtic Name: 2-(2-heptoxyethyl)-3,4-diphenyl-benzenecarbonitrile Openeye Name: 2-(2-heptoxyethyl)-3,4-diphenyl-benzonitrile CAS Name: 2-(2-heptoxyethyl)-3,4-diphenylbenzonitrile IUPAC Name: 2-(2-heptoxyethyl)-3,4-diphenylbenzonitrile Traditional Name: 2-(2-heptoxyethyl)-3,4-diphenyl-benzonitrile Formula: C28H31NO MolecularWeight: 397.55184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOCCC1=C(C=CC(=C1C2=CC=CC=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CCCCCCCOCCC1=C(C=CC(=C1C2=CC=CC=C2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C28H31NO/c1-2-3-4-5-12-20-30-21-19-27-25(22-29)17-18-26(23-13-8-6-9-14-23)28(27)24-15-10-7-11-16-24/h6-11,13-18H,2-5,12,19-21H2,1H3