methyl 4-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-(1,3-benzothiazol-2-yl)-1-piperidyl]methyl]benzoate CAS Name: 4-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]benzoate Traditional Name: 4-[[4-(1,3-benzothiazol-2-yl)piperidino]methyl]benzoic acid methyl ester Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2CCC(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2CCC(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H22N2O2S/c1-25-21(24)17-8-6-15(7-9-17)14-23-12-10-16(11-13-23)20-22-18-4-2-3-5-19(18)26-20/h2-9,16H,10-14H2,1H3