methyl 3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)propanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)propanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)propanoylamino]-4-methyl-benzoate CAS Name: 3-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxopropyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)propanoylamino]-4-methylbenzoate Traditional Name: 3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)propanoylamino]-4-methyl-benzoic acid methyl ester Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H21NO5/c1-13-3-6-15(20(23)24-2)12-16(13)21-19(22)8-5-14-4-7-17-18(11-14)26-10-9-25-17/h3-4,6-7,11-12H,5,8-10H2,1-2H3,(H,21,22)