4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-N,N-bis(2-hydroxyethyl)quinoline-3-carboxamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-N,N-bis(2-hydroxyethyl)quinoline-3-carboxamide Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-6-cyano-N,N-bis(2-hydroxyethyl)quinoline-3-carboxamide CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-N,N-bis(2-hydroxyethyl)-3-quinolinecarboxamide IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-N,N-bis(2-hydroxyethyl)quinoline-3-carboxamide Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-6-cyano-N,N-bis(2-hydroxyethyl)quinoline-3-carboxamide Formula: C23H23ClN4O4 MolecularWeight: 454.90612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=C3C=C(C=CC3=NC=C2C(=O)N(CCO)CCO)C#N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=C3C=C(C=CC3=NC=C2C(=O)N(CCO)CCO)C#N)Cl

InChI

InChI=1S/C23H23ClN4O4/c1-32-21-5-3-16(11-19(21)24)13-27-22-17-10-15(12-25)2-4-20(17)26-14-18(22)23(31)28(6-8-29)7-9-30/h2-5,10-11,14,29-30H,6-9,13H2,1H3,(H,26,27)