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

Systemtic Name: 4-[(3-bromophenyl)amino]-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile Openeye Name: 4-(3-bromoanilino)-6-methoxy-7-(3-morpholinopropoxy)quinoline-3-carbonitrile CAS Name: 4-(3-bromoanilino)-6-methoxy-7-[3-(4-morpholinyl)propoxy]-3-quinolinecarbonitrile IUPAC Name: 4-(3-bromoanilino)-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile Traditional Name: 4-(3-bromoanilino)-6-methoxy-7-(3-morpholinopropoxy)quinoline-3-carbonitrile Formula: C24H25BrN4O3 MolecularWeight: 497.3843

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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)OCCCN4CCOCC4

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC(=CC=C3)Br)OCCCN4CCOCC4

InChI

InChI=1S/C24H25BrN4O3/c1-30-22-13-20-21(14-23(22)32-9-3-6-29-7-10-31-11-8-29)27-16-17(15-26)24(20)28-19-5-2-4-18(25)12-19/h2,4-5,12-14,16H,3,6-11H2,1H3,(H,27,28)