methyl 2-[cyclopropyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)carbamoyl]benzoate

Systemtic Name: methyl 2-[cyclopropyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)carbamoyl]benzoate Openeye Name: methyl 2-[cyclopropyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)carbamoyl]benzoate CAS Name: 2-[[cyclopropyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[cyclopropyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)carbamoyl]benzoate Traditional Name: 2-[cyclopropyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)carbamoyl]benzoic acid methyl ester Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C(=O)N(CC2=CC3=C(C=C2)OCCO3)C4CC4

Isomeric SMILES

COC(=O)C1=CC=CC=C1C(=O)N(CC2=CC3=C(C=C2)OCCO3)C4CC4

InChI

InChI=1S/C21H21NO5/c1-25-21(24)17-5-3-2-4-16(17)20(23)22(15-7-8-15)13-14-6-9-18-19(12-14)27-11-10-26-18/h2-6,9,12,15H,7-8,10-11,13H2,1H3