ethyl 4-[4-[(phenylmethyl)-propyl-carbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-[(phenylmethyl)-propyl-carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[[4-[benzyl(propyl)carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 4-[[4-[oxo-[(phenylmethyl)-propylamino]methyl]-1-piperidinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[benzyl(propyl)carbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-[benzyl(propyl)carbamoyl]piperidino]sulfonylbenzoic acid ethyl ester Formula: C25H32N2O5S MolecularWeight: 472.59698

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCCN(CC1=CC=CC=C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C25H32N2O5S/c1-3-16-26(19-20-8-6-5-7-9-20)24(28)21-14-17-27(18-15-21)33(30,31)23-12-10-22(11-13-23)25(29)32-4-2/h5-13,21H,3-4,14-19H2,1-2H3