ethyl 4-[[1,3-benzodioxol-5-ylmethyl-(1-ethylpiperidin-4-yl)carbamoyl]amino]benzoate

Systemtic Name: ethyl 4-[[1,3-benzodioxol-5-ylmethyl-(1-ethylpiperidin-4-yl)carbamoyl]amino]benzoate Openeye Name: ethyl 4-[[1,3-benzodioxol-5-ylmethyl-(1-ethyl-4-piperidyl)carbamoyl]amino]benzoate CAS Name: 4-[[[1,3-benzodioxol-5-ylmethyl-(1-ethyl-4-piperidinyl)amino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[1,3-benzodioxol-5-ylmethyl-(1-ethylpiperidin-4-yl)carbamoyl]amino]benzoate Traditional Name: 4-[[(1-ethyl-4-piperidyl)-piperonyl-carbamoyl]amino]benzoic acid ethyl ester Formula: C25H31N3O5 MolecularWeight: 453.53074

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)N(CC2=CC3=C(C=C2)OCO3)C(=O)NC4=CC=C(C=C4)C(=O)OCC

Isomeric SMILES

CCN1CCC(CC1)N(CC2=CC3=C(C=C2)OCO3)C(=O)NC4=CC=C(C=C4)C(=O)OCC

InChI

InChI=1S/C25H31N3O5/c1-3-27-13-11-21(12-14-27)28(16-18-5-10-22-23(15-18)33-17-32-22)25(30)26-20-8-6-19(7-9-20)24(29)31-4-2/h5-10,15,21H,3-4,11-14,16-17H2,1-2H3,(H,26,30)