4-[[3-chloranyl-4-(2-dimethylaminoethyloxy)-5-methoxy-phenyl]methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-chloranyl-4-(2-dimethylaminoethyloxy)-5-methoxy-phenyl]methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[3-chloro-4-(2-dimethylaminoethyloxy)-5-methoxy-phenyl]methylamino]-4-oxo-butanoic acid CAS Name: 4-[[3-chloro-4-(2-dimethylaminoethyloxy)-5-methoxyphenyl]methylamino]-4-oxobutanoic acid IUPAC Name: 4-[[3-chloro-4-(2-dimethylaminoethyloxy)-5-methoxyphenyl]methylamino]-4-oxobutanoic acid Traditional Name: 4-[[3-chloro-4-(2-dimethylaminoethyloxy)-5-methoxy-benzyl]amino]-4-keto-butyric acid Formula: C16H23ClN2O5 MolecularWeight: 358.81722

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=C(C=C(C=C1Cl)CNC(=O)CCC(=O)O)OC

Isomeric SMILES

CN(C)CCOC1=C(C=C(C=C1Cl)CNC(=O)CCC(=O)O)OC

InChI

InChI=1S/C16H23ClN2O5/c1-19(2)6-7-24-16-12(17)8-11(9-13(16)23-3)10-18-14(20)4-5-15(21)22/h8-9H,4-7,10H2,1-3H3,(H,18,20)(H,21,22)