4-[[2,4-bis(chloranyl)-5-methoxy-phenyl]amino]-7-[3,4-bis(morpholin-4-ylmethyl)phenyl]quinoline-3-carbonitrile

Systemtic Name: 4-[[2,4-bis(chloranyl)-5-methoxy-phenyl]amino]-7-[3,4-bis(morpholin-4-ylmethyl)phenyl]quinoline-3-carbonitrile Openeye Name: 7-[3,4-bis(morpholinomethyl)phenyl]-4-(2,4-dichloro-5-methoxy-anilino)quinoline-3-carbonitrile CAS Name: 7-[3,4-bis(4-morpholinylmethyl)phenyl]-4-(2,4-dichloro-5-methoxyanilino)-3-quinolinecarbonitrile IUPAC Name: 7-[3,4-bis(morpholin-4-ylmethyl)phenyl]-4-(2,4-dichloro-5-methoxyanilino)quinoline-3-carbonitrile Traditional Name: 7-[3,4-bis(morpholinomethyl)phenyl]-4-(2,4-dichloro-5-methoxy-anilino)quinoline-3-carbonitrile Formula: C33H33Cl2N5O3 MolecularWeight: 618.55282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)NC2=C3C=CC(=CC3=NC=C2C#N)C4=CC(=C(C=C4)CN5CCOCC5)CN6CCOCC6)Cl)Cl

Isomeric SMILES

COC1=C(C=C(C(=C1)NC2=C3C=CC(=CC3=NC=C2C#N)C4=CC(=C(C=C4)CN5CCOCC5)CN6CCOCC6)Cl)Cl

InChI

InChI=1S/C33H33Cl2N5O3/c1-41-32-17-31(28(34)16-29(32)35)38-33-26(18-36)19-37-30-15-23(4-5-27(30)33)22-2-3-24(20-39-6-10-42-11-7-39)25(14-22)21-40-8-12-43-13-9-40/h2-5,14-17,19H,6-13,20-21H2,1H3,(H,37,38)