methyl 4-[2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-2-oxidanylidene-ethoxy]-3-methoxy-benzoate

Systemtic Name: methyl 4-[2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-2-oxidanylidene-ethoxy]-3-methoxy-benzoate Openeye Name: methyl 4-[2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-2-oxo-ethoxy]-3-methoxy-benzoate CAS Name: 4-[2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-2-oxoethoxy]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-2-oxoethoxy]-3-methoxybenzoate Traditional Name: 4-[2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-2-keto-ethoxy]-3-methoxy-benzoic acid methyl ester Formula: C20H21NO7 MolecularWeight: 387.38324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC)OCC(=O)NCC2COC3=CC=CC=C3O2

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC)OCC(=O)NC[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C20H21NO7/c1-24-18-9-13(20(23)25-2)7-8-16(18)27-12-19(22)21-10-14-11-26-15-5-3-4-6-17(15)28-14/h3-9,14H,10-12H2,1-2H3,(H,21,22)/t14-/m0/s1