4-[(3-bromophenyl)amino]-6,7,8-trimethoxy-quinoline-3-carbonitrile

Systemtic Name: 4-[(3-bromophenyl)amino]-6,7,8-trimethoxy-quinoline-3-carbonitrile Openeye Name: 4-(3-bromoanilino)-6,7,8-trimethoxy-quinoline-3-carbonitrile CAS Name: 4-(3-bromoanilino)-6,7,8-trimethoxy-3-quinolinecarbonitrile IUPAC Name: 4-(3-bromoanilino)-6,7,8-trimethoxyquinoline-3-carbonitrile Traditional Name: 4-(3-bromoanilino)-6,7,8-trimethoxy-quinoline-3-carbonitrile Formula: C19H16BrN3O3 MolecularWeight: 414.25264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)C(=C(C=N2)C#N)NC3=CC(=CC=C3)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C2C(=C1)C(=C(C=N2)C#N)NC3=CC(=CC=C3)Br)OC)OC

InChI

InChI=1S/C19H16BrN3O3/c1-24-15-8-14-16(23-13-6-4-5-12(20)7-13)11(9-21)10-22-17(14)19(26-3)18(15)25-2/h4-8,10H,1-3H3,(H,22,23)