4-(3-phenylmethoxy-2-tetradecoxy-propoxy)benzenecarbonitrile

Systemtic Name: 4-(3-phenylmethoxy-2-tetradecoxy-propoxy)benzenecarbonitrile Openeye Name: 4-(3-benzyloxy-2-tetradecoxy-propoxy)benzonitrile CAS Name: 4-(3-phenylmethoxy-2-tetradecoxypropoxy)benzonitrile IUPAC Name: 4-(3-phenylmethoxy-2-tetradecoxypropoxy)benzonitrile Traditional Name: 4-(3-benzoxy-2-myristyloxy-propoxy)benzonitrile Formula: C31H45NO3 MolecularWeight: 479.6939

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(COCC1=CC=CC=C1)COC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCCCCCCCCCCOC(COCC1=CC=CC=C1)COC2=CC=C(C=C2)C#N

InChI

InChI=1S/C31H45NO3/c1-2-3-4-5-6-7-8-9-10-11-12-16-23-34-31(26-33-25-29-17-14-13-15-18-29)27-35-30-21-19-28(24-32)20-22-30/h13-15,17-22,31H,2-12,16,23,25-27H2,1H3