4-[3-chloranyl-4-(methylcarbamoylamino)phenoxy]-N-ethyl-7-(2-oxidanyl-3-pyrrolidin-1-yl-propoxy)quinoline-6-carboxamide

Systemtic Name: 4-[3-chloranyl-4-(methylcarbamoylamino)phenoxy]-N-ethyl-7-(2-oxidanyl-3-pyrrolidin-1-yl-propoxy)quinoline-6-carboxamide Openeye Name: 4-[3-chloro-4-(methylcarbamoylamino)phenoxy]-N-ethyl-7-(2-hydroxy-3-pyrrolidin-1-yl-propoxy)quinoline-6-carboxamide CAS Name: 4-[3-chloro-4-(methylcarbamoylamino)phenoxy]-N-ethyl-7-[2-hydroxy-3-(1-pyrrolidinyl)propoxy]-6-quinolinecarboxamide IUPAC Name: 4-[3-chloro-4-(methylcarbamoylamino)phenoxy]-N-ethyl-7-(2-hydroxy-3-pyrrolidin-1-ylpropoxy)quinoline-6-carboxamide Traditional Name: 4-[3-chloro-4-(methylcarbamoylamino)phenoxy]-N-ethyl-7-(2-hydroxy-3-pyrrolidino-propoxy)quinoline-6-carboxamide Formula: C27H32ClN5O5 MolecularWeight: 542.02648

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC2=C(C=CN=C2C=C1OCC(CN3CCCC3)O)OC4=CC(=C(C=C4)NC(=O)NC)Cl

Isomeric SMILES

CCNC(=O)C1=CC2=C(C=CN=C2C=C1OCC(CN3CCCC3)O)OC4=CC(=C(C=C4)NC(=O)NC)Cl

InChI

InChI=1S/C27H32ClN5O5/c1-3-30-26(35)20-13-19-23(14-25(20)37-16-17(34)15-33-10-4-5-11-33)31-9-8-24(19)38-18-6-7-22(21(28)12-18)32-27(36)29-2/h6-9,12-14,17,34H,3-5,10-11,15-16H2,1-2H3,(H,30,35)(H2,29,32,36)