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

Systemtic Name: methyl 4-[[2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethanoyl-methyl-amino]methyl]benzoate Openeye Name: methyl 4-[[[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetyl]-methyl-amino]methyl]benzoate CAS Name: 4-[[[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-oxoethyl]-methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetyl]-methylamino]methyl]benzoate Traditional Name: 4-[[[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetyl]-methyl-amino]methyl]benzoic acid methyl ester Formula: C20H20ClNO5 MolecularWeight: 389.8295

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)CC2=CC3=C(C(=C2)Cl)OCCO3

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)CC2=CC3=C(C(=C2)Cl)OCCO3

InChI

InChI=1S/C20H20ClNO5/c1-22(12-13-3-5-15(6-4-13)20(24)25-2)18(23)11-14-9-16(21)19-17(10-14)26-7-8-27-19/h3-6,9-10H,7-8,11-12H2,1-2H3