4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-3-[(cyclopentylamino)methyl]quinoline-6-carbonitrile

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-3-[(cyclopentylamino)methyl]quinoline-6-carbonitrile Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-3-[(cyclopentylamino)methyl]quinoline-6-carbonitrile CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-3-[(cyclopentylamino)methyl]-6-quinolinecarbonitrile IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-3-[(cyclopentylamino)methyl]quinoline-6-carbonitrile Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-3-[(cyclopentylamino)methyl]quinoline-6-carbonitrile Formula: C24H25ClN4O MolecularWeight: 420.9345

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=C3C=C(C=CC3=NC=C2CNC4CCCC4)C#N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=C3C=C(C=CC3=NC=C2CNC4CCCC4)C#N)Cl

InChI

InChI=1S/C24H25ClN4O/c1-30-23-9-7-17(11-21(23)25)13-29-24-18(14-27-19-4-2-3-5-19)15-28-22-8-6-16(12-26)10-20(22)24/h6-11,15,19,27H,2-5,13-14H2,1H3,(H,28,29)