3-[(2-aminocarbonylphenyl)methoxy]-4-(1,3-benzodioxol-5-yl)piperidine-1-carboxylic acid

Systemtic Name: 3-[(2-aminocarbonylphenyl)methoxy]-4-(1,3-benzodioxol-5-yl)piperidine-1-carboxylic acid Openeye Name: 4-(1,3-benzodioxol-5-yl)-3-[(2-carbamoylphenyl)methoxy]piperidine-1-carboxylic acid CAS Name: 4-(1,3-benzodioxol-5-yl)-3-[(2-carbamoylphenyl)methoxy]-1-piperidinecarboxylic acid IUPAC Name: 4-(1,3-benzodioxol-5-yl)-3-[(2-carbamoylphenyl)methoxy]piperidine-1-carboxylic acid Traditional Name: 4-(1,3-benzodioxol-5-yl)-3-(2-carbamoylbenzyl)oxy-piperidine-1-carboxylic acid Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1C2=CC3=C(C=C2)OCO3)OCC4=CC=CC=C4C(=O)N)C(=O)O

Isomeric SMILES

C1CN(CC(C1C2=CC3=C(C=C2)OCO3)OCC4=CC=CC=C4C(=O)N)C(=O)O

InChI

InChI=1S/C21H22N2O6/c22-20(24)16-4-2-1-3-14(16)11-27-19-10-23(21(25)26)8-7-15(19)13-5-6-17-18(9-13)29-12-28-17/h1-6,9,15,19H,7-8,10-12H2,(H2,22,24)(H,25,26)