2-azanyl-4-(3-bromanyl-4,5-dimethoxy-phenyl)-4,7-dihydropyrano[2,3-e]indole-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-bromanyl-4,5-dimethoxy-phenyl)-4,7-dihydropyrano[2,3-e]indole-3-carbonitrile Openeye Name: 2-amino-4-(3-bromo-4,5-dimethoxy-phenyl)-4,7-dihydropyrano[2,3-e]indole-3-carbonitrile CAS Name: 2-amino-4-(3-bromo-4,5-dimethoxyphenyl)-4,7-dihydropyrano[2,3-e]indole-3-carbonitrile IUPAC Name: 2-amino-4-(3-bromo-4,5-dimethoxyphenyl)-4,7-dihydropyrano[2,3-e]indole-3-carbonitrile Traditional Name: 2-amino-4-(3-bromo-4,5-dimethoxy-phenyl)-4,7-dihydropyran[2,3-e]indole-3-carbonitrile Formula: C20H16BrN3O3 MolecularWeight: 426.26334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2C3=C(C4=C(C=C3)NC=C4)OC(=C2C#N)N)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C2C3=C(C4=C(C=C3)NC=C4)OC(=C2C#N)N)Br)OC

InChI

InChI=1S/C20H16BrN3O3/c1-25-16-8-10(7-14(21)19(16)26-2)17-12-3-4-15-11(5-6-24-15)18(12)27-20(23)13(17)9-22/h3-8,17,24H,23H2,1-2H3