2-[(3-bromophenyl)amino]-7-ethoxy-6-methoxy-quinoline-3-carbonitrile

Systemtic Name: 2-[(3-bromophenyl)amino]-7-ethoxy-6-methoxy-quinoline-3-carbonitrile Openeye Name: 2-(3-bromoanilino)-7-ethoxy-6-methoxy-quinoline-3-carbonitrile CAS Name: 2-(3-bromoanilino)-7-ethoxy-6-methoxy-3-quinolinecarbonitrile IUPAC Name: 2-(3-bromoanilino)-7-ethoxy-6-methoxyquinoline-3-carbonitrile Traditional Name: 2-(3-bromoanilino)-7-ethoxy-6-methoxy-quinoline-3-carbonitrile Formula: C19H16BrN3O2 MolecularWeight: 398.25324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C=C(C(=NC2=C1)NC3=CC(=CC=C3)Br)C#N)OC

Isomeric SMILES

CCOC1=C(C=C2C=C(C(=NC2=C1)NC3=CC(=CC=C3)Br)C#N)OC

InChI

InChI=1S/C19H16BrN3O2/c1-3-25-18-10-16-12(8-17(18)24-2)7-13(11-21)19(23-16)22-15-6-4-5-14(20)9-15/h4-10H,3H2,1-2H3,(H,22,23)