methyl 4-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methylcarbamoyl]benzoate

Systemtic Name: methyl 4-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methylcarbamoyl]benzoate Openeye Name: methyl 4-[[1-(2-thienylmethyl)-4-piperidyl]methylcarbamoyl]benzoate CAS Name: 4-[oxo-[[1-(thiophen-2-ylmethyl)-4-piperidinyl]methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methylcarbamoyl]benzoate Traditional Name: 4-[[1-(2-thenyl)-4-piperidyl]methylcarbamoyl]benzoic acid methyl ester Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NCC2CCN(CC2)CC3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NCC2CCN(CC2)CC3=CC=CS3

InChI

InChI=1S/C20H24N2O3S/c1-25-20(24)17-6-4-16(5-7-17)19(23)21-13-15-8-10-22(11-9-15)14-18-3-2-12-26-18/h2-7,12,15H,8-11,13-14H2,1H3,(H,21,23)