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

Systemtic Name: 4-[3-chloranyl-4-(methylcarbamoylamino)phenoxy]-7-[3-(diethylamino)-2-oxidanyl-propoxy]-N-ethyl-quinoline-6-carboxamide Openeye Name: 4-[3-chloro-4-(methylcarbamoylamino)phenoxy]-7-[3-(diethylamino)-2-hydroxy-propoxy]-N-ethyl-quinoline-6-carboxamide CAS Name: 4-[3-chloro-4-(methylcarbamoylamino)phenoxy]-7-[3-(diethylamino)-2-hydroxypropoxy]-N-ethyl-6-quinolinecarboxamide IUPAC Name: 4-[3-chloro-4-(methylcarbamoylamino)phenoxy]-7-[3-(diethylamino)-2-hydroxypropoxy]-N-ethylquinoline-6-carboxamide Traditional Name: 4-[3-chloro-4-(methylcarbamoylamino)phenoxy]-7-[3-(diethylamino)-2-hydroxy-propoxy]-N-ethyl-quinoline-6-carboxamide Formula: C27H34ClN5O5 MolecularWeight: 544.04236

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC2=C(C=CN=C2C=C1OCC(CN(CC)CC)O)OC3=CC(=C(C=C3)NC(=O)NC)Cl

Isomeric SMILES

CCNC(=O)C1=CC2=C(C=CN=C2C=C1OCC(CN(CC)CC)O)OC3=CC(=C(C=C3)NC(=O)NC)Cl

InChI

InChI=1S/C27H34ClN5O5/c1-5-30-26(35)20-13-19-23(14-25(20)37-16-17(34)15-33(6-2)7-3)31-11-10-24(19)38-18-8-9-22(21(28)12-18)32-27(36)29-4/h8-14,17,34H,5-7,15-16H2,1-4H3,(H,30,35)(H2,29,32,36)