4-[2-azanyl-3-chloranyl-5-methanoyl-4-(methylamino)phenoxy]-N-methyl-7-[(2R)-2-oxidanyl-3-pyrrolidin-1-yl-propoxy]quinoline-6-carboxamide

Systemtic Name: 4-[2-azanyl-3-chloranyl-5-methanoyl-4-(methylamino)phenoxy]-N-methyl-7-[(2R)-2-oxidanyl-3-pyrrolidin-1-yl-propoxy]quinoline-6-carboxamide Openeye Name: 4-[2-amino-3-chloro-5-formyl-4-(methylamino)phenoxy]-7-[(2R)-2-hydroxy-3-pyrrolidin-1-yl-propoxy]-N-methyl-quinoline-6-carboxamide CAS Name: 4-[2-amino-3-chloro-5-formyl-4-(methylamino)phenoxy]-7-[(2R)-2-hydroxy-3-(1-pyrrolidinyl)propoxy]-N-methyl-6-quinolinecarboxamide IUPAC Name: 4-[2-amino-3-chloro-5-formyl-4-(methylamino)phenoxy]-7-[(2R)-2-hydroxy-3-pyrrolidin-1-ylpropoxy]-N-methylquinoline-6-carboxamide Traditional Name: 4-[2-amino-3-chloro-5-formyl-4-(methylamino)phenoxy]-7-[(2R)-2-hydroxy-3-pyrrolidino-propoxy]-N-methyl-quinoline-6-carboxamide Formula: C26H30ClN5O5 MolecularWeight: 527.9999

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C(=C(C=C1C=O)OC2=C3C=C(C(=CC3=NC=C2)OCC(CN4CCCC4)O)C(=O)NC)N)Cl

Isomeric SMILES

CNC1=C(C(=C(C=C1C=O)OC2=C3C=C(C(=CC3=NC=C2)OC[C@@H](CN4CCCC4)O)C(=O)NC)N)Cl

InChI

InChI=1S/C26H30ClN5O5/c1-29-25-15(13-33)9-22(24(28)23(25)27)37-20-5-6-31-19-11-21(18(10-17(19)20)26(35)30-2)36-14-16(34)12-32-7-3-4-8-32/h5-6,9-11,13,16,29,34H,3-4,7-8,12,14,28H2,1-2H3,(H,30,35)/t16-/m1/s1