[2-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]amino]-2-oxidanylidene-ethyl] 3-oxidanylbenzoate

Systemtic Name: [2-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]amino]-2-oxidanylidene-ethyl] 3-oxidanylbenzoate Openeye Name: [2-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]amino]-2-oxo-ethyl] 3-hydroxybenzoate CAS Name: 3-hydroxybenzoic acid [2-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]amino]-2-oxoethyl] 3-hydroxybenzoate Traditional Name: 3-hydroxybenzoic acid [2-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]amino]-2-keto-ethyl] ester Formula: C21H23NO6 MolecularWeight: 385.41042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=O)COC(=O)C3=CC(=CC=C3)O

Isomeric SMILES

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=O)COC(=O)C3=CC(=CC=C3)O

InChI

InChI=1S/C21H23NO6/c1-13(2)20(14-6-7-17-18(11-14)27-9-8-26-17)22-19(24)12-28-21(25)15-4-3-5-16(23)10-15/h3-7,10-11,13,20,23H,8-9,12H2,1-2H3,(H,22,24)