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

Systemtic Name: 4-[2-azanyl-3-chloranyl-4-(methylcarbamoylamino)phenoxy]-N-methyl-7-[(2R)-2-oxidanyl-3-pyrrolidin-1-yl-propoxy]quinoline-6-carboxamide Openeye Name: 4-[2-amino-3-chloro-4-(methylcarbamoylamino)phenoxy]-7-[(2R)-2-hydroxy-3-pyrrolidin-1-yl-propoxy]-N-methyl-quinoline-6-carboxamide CAS Name: 4-[2-amino-3-chloro-4-(methylcarbamoylamino)phenoxy]-7-[(2R)-2-hydroxy-3-(1-pyrrolidinyl)propoxy]-N-methyl-6-quinolinecarboxamide IUPAC Name: 4-[2-amino-3-chloro-4-(methylcarbamoylamino)phenoxy]-7-[(2R)-2-hydroxy-3-pyrrolidin-1-ylpropoxy]-N-methylquinoline-6-carboxamide Traditional Name: 4-[2-amino-3-chloro-4-(methylcarbamoylamino)phenoxy]-7-[(2R)-2-hydroxy-3-pyrrolidino-propoxy]-N-methyl-quinoline-6-carboxamide Formula: C26H31ClN6O5 MolecularWeight: 543.01454

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC2=C(C=CN=C2C=C1OCC(CN3CCCC3)O)OC4=C(C(=C(C=C4)NC(=O)NC)Cl)N

Isomeric SMILES

CNC(=O)C1=CC2=C(C=CN=C2C=C1OC[C@@H](CN3CCCC3)O)OC4=C(C(=C(C=C4)NC(=O)NC)Cl)N

InChI

InChI=1S/C26H31ClN6O5/c1-29-25(35)17-11-16-19(12-22(17)37-14-15(34)13-33-9-3-4-10-33)31-8-7-20(16)38-21-6-5-18(23(27)24(21)28)32-26(36)30-2/h5-8,11-12,15,34H,3-4,9-10,13-14,28H2,1-2H3,(H,29,35)(H2,30,32,36)/t15-/m1/s1