2-[(3-chloranyl-4-pyridin-4-yloxy-phenyl)amino]-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile

Systemtic Name: 2-[(3-chloranyl-4-pyridin-4-yloxy-phenyl)amino]-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile Openeye Name: 2-[3-chloro-4-(4-pyridyloxy)anilino]-6-methoxy-7-(3-morpholinopropoxy)quinoline-3-carbonitrile CAS Name: 2-(3-chloro-4-pyridin-4-yloxyanilino)-6-methoxy-7-[3-(4-morpholinyl)propoxy]-3-quinolinecarbonitrile IUPAC Name: 2-(3-chloro-4-pyridin-4-yloxyanilino)-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile Traditional Name: 2-[3-chloro-4-(4-pyridyloxy)anilino]-6-methoxy-7-(3-morpholinopropoxy)quinoline-3-carbonitrile Formula: C29H28ClN5O4 MolecularWeight: 546.01672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=C(C(=N2)NC3=CC(=C(C=C3)OC4=CC=NC=C4)Cl)C#N)OCCCN5CCOCC5

Isomeric SMILES

COC1=C(C=C2C(=C1)C=C(C(=N2)NC3=CC(=C(C=C3)OC4=CC=NC=C4)Cl)C#N)OCCCN5CCOCC5

InChI

InChI=1S/C29H28ClN5O4/c1-36-27-16-20-15-21(19-31)29(33-22-3-4-26(24(30)17-22)39-23-5-7-32-8-6-23)34-25(20)18-28(27)38-12-2-9-35-10-13-37-14-11-35/h3-8,15-18H,2,9-14H2,1H3,(H,33,34)