5-[1,4-bis(oxidanyl)-4-(3,4,5-trimethoxyphenyl)butyl]-3-methoxy-2-propoxy-benzenecarbonitrile

Systemtic Name: 5-[1,4-bis(oxidanyl)-4-(3,4,5-trimethoxyphenyl)butyl]-3-methoxy-2-propoxy-benzenecarbonitrile Openeye Name: 5-[1,4-dihydroxy-4-(3,4,5-trimethoxyphenyl)butyl]-3-methoxy-2-propoxy-benzonitrile CAS Name: 5-[1,4-dihydroxy-4-(3,4,5-trimethoxyphenyl)butyl]-3-methoxy-2-propoxybenzonitrile IUPAC Name: 5-[1,4-dihydroxy-4-(3,4,5-trimethoxyphenyl)butyl]-3-methoxy-2-propoxybenzonitrile Traditional Name: 5-[1,4-dihydroxy-4-(3,4,5-trimethoxyphenyl)butyl]-3-methoxy-2-propoxy-benzonitrile Formula: C24H31NO7 MolecularWeight: 445.50544

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1C#N)C(CCC(C2=CC(=C(C(=C2)OC)OC)OC)O)O)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1C#N)C(CCC(C2=CC(=C(C(=C2)OC)OC)OC)O)O)OC

InChI

InChI=1S/C24H31NO7/c1-6-9-32-23-17(14-25)10-15(11-20(23)28-2)18(26)7-8-19(27)16-12-21(29-3)24(31-5)22(13-16)30-4/h10-13,18-19,26-27H,6-9H2,1-5H3