methyl 5-[2-[4-(4-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-1-oxidanyl-ethyl]-2-oxidanyl-benzoate

Systemtic Name: methyl 5-[2-[4-(4-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-1-oxidanyl-ethyl]-2-oxidanyl-benzoate Openeye Name: methyl 2-hydroxy-5-[1-hydroxy-2-[4-(4-methylthiazol-2-yl)piperazin-1-yl]ethyl]benzoate CAS Name: 2-hydroxy-5-[1-hydroxy-2-[4-(4-methyl-2-thiazolyl)-1-piperazinyl]ethyl]benzoic acid methyl ester IUPAC Name: methyl 2-hydroxy-5-[1-hydroxy-2-[4-(4-methyl-1,3-thiazol-2-yl)piperazin-1-yl]ethyl]benzoate Traditional Name: 2-hydroxy-5-[1-hydroxy-2-[4-(4-methylthiazol-2-yl)piperazino]ethyl]benzoic acid methyl ester Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)N2CCN(CC2)CC(C3=CC(=C(C=C3)O)C(=O)OC)O

Isomeric SMILES

CC1=CSC(=N1)N2CCN(CC2)CC(C3=CC(=C(C=C3)O)C(=O)OC)O

InChI

InChI=1S/C18H23N3O4S/c1-12-11-26-18(19-12)21-7-5-20(6-8-21)10-16(23)13-3-4-15(22)14(9-13)17(24)25-2/h3-4,9,11,16,22-23H,5-8,10H2,1-2H3