methyl 4-[[2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetyl]amino]methyl]benzoic acid methyl ester Formula: C19H18ClNO5 MolecularWeight: 375.80292

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)CC2=CC3=C(C(=C2)Cl)OCCO3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)CC2=CC3=C(C(=C2)Cl)OCCO3

InChI

InChI=1S/C19H18ClNO5/c1-24-19(23)14-4-2-12(3-5-14)11-21-17(22)10-13-8-15(20)18-16(9-13)25-6-7-26-18/h2-5,8-9H,6-7,10-11H2,1H3,(H,21,22)