3-(2-bromanyl-3,4,5-trimethoxy-phenyl)-2-(1-methylindol-2-yl)-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(2-bromanyl-3,4,5-trimethoxy-phenyl)-2-(1-methylindol-2-yl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(2-bromo-3,4,5-trimethoxy-phenyl)-2-(1-methylindol-2-yl)-3-oxo-propanenitrile CAS Name: 3-(2-bromo-3,4,5-trimethoxyphenyl)-2-(1-methyl-2-indolyl)-3-oxopropanenitrile IUPAC Name: 3-(2-bromo-3,4,5-trimethoxyphenyl)-2-(1-methylindol-2-yl)-3-oxopropanenitrile Traditional Name: 3-(2-bromo-3,4,5-trimethoxy-phenyl)-3-keto-2-(1-methylindol-2-yl)propionitrile Formula: C21H19BrN2O4 MolecularWeight: 443.29056

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C=C1C(C#N)C(=O)C3=CC(=C(C(=C3Br)OC)OC)OC

Isomeric SMILES

CN1C2=CC=CC=C2C=C1C(C#N)C(=O)C3=CC(=C(C(=C3Br)OC)OC)OC

InChI

InChI=1S/C21H19BrN2O4/c1-24-15-8-6-5-7-12(15)9-16(24)14(11-23)19(25)13-10-17(26-2)20(27-3)21(28-4)18(13)22/h5-10,14H,1-4H3