(2-methoxy-5-piperidin-1-ylcarbothioyl-phenyl) benzoate

Systemtic Name: (2-methoxy-5-piperidin-1-ylcarbothioyl-phenyl) benzoate Openeye Name: [2-methoxy-5-(piperidine-1-carbothioyl)phenyl] benzoate CAS Name: benzoic acid [2-methoxy-5-[1-piperidinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [2-methoxy-5-(piperidine-1-carbothioyl)phenyl] benzoate Traditional Name: benzoic acid [2-methoxy-5-(piperidine-1-carbothioyl)phenyl] ester Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=S)N2CCCCC2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=S)N2CCCCC2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H21NO3S/c1-23-17-11-10-16(19(25)21-12-6-3-7-13-21)14-18(17)24-20(22)15-8-4-2-5-9-15/h2,4-5,8-11,14H,3,6-7,12-13H2,1H3