(2-azanyl-2-oxidanylidene-ethyl) 3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-4-methyl-benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-4-methyl-benzoate Openeye Name: (2-amino-2-oxo-ethyl) 3-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-4-methyl-benzoate CAS Name: 3-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]amino]-4-methylbenzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 3-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-4-methylbenzoate Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-carbonylamino)-4-methyl-benzoic acid (2-amino-2-keto-ethyl) ester Formula: C19H18N2O6 MolecularWeight: 370.35602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)N)NC(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)N)NC(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C19H18N2O6/c1-11-2-3-13(19(24)27-10-17(20)22)8-14(11)21-18(23)12-4-5-15-16(9-12)26-7-6-25-15/h2-5,8-9H,6-7,10H2,1H3,(H2,20,22)(H,21,23)