(E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)-2-[(5-methoxy-1H-indol-3-yl)carbonyl]prop-2-enenitrile

Systemtic Name: (E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)-2-[(5-methoxy-1H-indol-3-yl)carbonyl]prop-2-enenitrile Openeye Name: (E)-3-(3-chloro-4,5-dimethoxy-phenyl)-2-(5-methoxy-1H-indole-3-carbonyl)prop-2-enenitrile CAS Name: (E)-3-(3-chloro-4,5-dimethoxyphenyl)-2-[(5-methoxy-1H-indol-3-yl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3-chloro-4,5-dimethoxyphenyl)-2-(5-methoxy-1H-indole-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(3-chloro-4,5-dimethoxy-phenyl)-2-(5-methoxy-1H-indole-3-carbonyl)acrylonitrile Formula: C21H17ClN2O4 MolecularWeight: 396.82368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC=C2C(=O)C(=CC3=CC(=C(C(=C3)Cl)OC)OC)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)NC=C2C(=O)/C(=C/C3=CC(=C(C(=C3)Cl)OC)OC)/C#N

InChI

InChI=1S/C21H17ClN2O4/c1-26-14-4-5-18-15(9-14)16(11-24-18)20(25)13(10-23)6-12-7-17(22)21(28-3)19(8-12)27-2/h4-9,11,24H,1-3H3/b13-6+