6-(1H-isoindol-5-ylamino)-6-(3,4,5-trimethoxyphenyl)cyclohexa-1,3-diene-1-carbonitrile

Systemtic Name: 6-(1H-isoindol-5-ylamino)-6-(3,4,5-trimethoxyphenyl)cyclohexa-1,3-diene-1-carbonitrile Openeye Name: 6-(1H-isoindol-5-ylamino)-6-(3,4,5-trimethoxyphenyl)cyclohexa-1,3-diene-1-carbonitrile CAS Name: 6-(1H-isoindol-5-ylamino)-6-(3,4,5-trimethoxyphenyl)-1-cyclohexa-1,3-dienecarbonitrile IUPAC Name: 6-(1H-isoindol-5-ylamino)-6-(3,4,5-trimethoxyphenyl)cyclohexa-1,3-diene-1-carbonitrile Traditional Name: 6-(1H-isoindol-5-ylamino)-6-(3,4,5-trimethoxyphenyl)cyclohexa-1,3-diene-1-carbonitrile Formula: C24H23N3O3 MolecularWeight: 401.45772

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2(CC=CC=C2C#N)NC3=CC4=C(CN=C4)C=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2(CC=CC=C2C#N)NC3=CC4=C(CN=C4)C=C3

InChI

InChI=1S/C24H23N3O3/c1-28-21-11-19(12-22(29-2)23(21)30-3)24(9-5-4-6-18(24)13-25)27-20-8-7-16-14-26-15-17(16)10-20/h4-8,10-12,15,27H,9,14H2,1-3H3