4-[[5-chloranyl-2-[3-(dimethylamino)propoxy]phenyl]methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[5-chloranyl-2-[3-(dimethylamino)propoxy]phenyl]methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[5-chloro-2-[3-(dimethylamino)propoxy]phenyl]methylamino]-4-oxo-butanoic acid CAS Name: 4-[[5-chloro-2-[3-(dimethylamino)propoxy]phenyl]methylamino]-4-oxobutanoic acid IUPAC Name: 4-[[5-chloro-2-[3-(dimethylamino)propoxy]phenyl]methylamino]-4-oxobutanoic acid Traditional Name: 4-[[5-chloro-2-[3-(dimethylamino)propoxy]benzyl]amino]-4-keto-butyric acid Formula: C16H23ClN2O4 MolecularWeight: 342.81782

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC1=C(C=C(C=C1)Cl)CNC(=O)CCC(=O)O

Isomeric SMILES

CN(C)CCCOC1=C(C=C(C=C1)Cl)CNC(=O)CCC(=O)O

InChI

InChI=1S/C16H23ClN2O4/c1-19(2)8-3-9-23-14-5-4-13(17)10-12(14)11-18-15(20)6-7-16(21)22/h4-5,10H,3,6-9,11H2,1-2H3,(H,18,20)(H,21,22)