3-(1,3-benzodioxol-5-ylcarbonylamino)-4-methoxy-benzoic acid

Systemtic Name: 3-(1,3-benzodioxol-5-ylcarbonylamino)-4-methoxy-benzoic acid Openeye Name: 3-(1,3-benzodioxole-5-carbonylamino)-4-methoxy-benzoic acid CAS Name: 3-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-4-methoxybenzoic acid IUPAC Name: 3-(1,3-benzodioxole-5-carbonylamino)-4-methoxybenzoic acid Traditional Name: 4-methoxy-3-(piperonyloylamino)benzoic acid Formula: C16H13NO6 MolecularWeight: 315.27752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)O)NC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O)NC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H13NO6/c1-21-12-4-3-10(16(19)20)6-11(12)17-15(18)9-2-5-13-14(7-9)23-8-22-13/h2-7H,8H2,1H3,(H,17,18)(H,19,20)