4-[(3-bromophenyl)amino]-6-ethoxy-7-methoxy-quinoline-3-carbonitrile

Systemtic Name: 4-[(3-bromophenyl)amino]-6-ethoxy-7-methoxy-quinoline-3-carbonitrile Openeye Name: 4-(3-bromoanilino)-6-ethoxy-7-methoxy-quinoline-3-carbonitrile CAS Name: 4-(3-bromoanilino)-6-ethoxy-7-methoxy-3-quinolinecarbonitrile IUPAC Name: 4-(3-bromoanilino)-6-ethoxy-7-methoxyquinoline-3-carbonitrile Traditional Name: 4-(3-bromoanilino)-6-ethoxy-7-methoxy-quinoline-3-carbonitrile Formula: C19H16BrN3O2 MolecularWeight: 398.25324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC(=CC=C3)Br)OC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC(=CC=C3)Br)OC

InChI

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