3-methoxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(2-oxidanylidenebutyl)benzoic acid

Systemtic Name: 3-methoxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(2-oxidanylidenebutyl)benzoic acid Openeye Name: 3-(tert-butoxycarbonylamino)-5-methoxy-4-(2-oxobutyl)benzoic acid CAS Name: 3-methoxy-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-(2-oxobutyl)benzoic acid IUPAC Name: 3-methoxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(2-oxobutyl)benzoic acid Traditional Name: 3-(tert-butoxycarbonylamino)-4-(2-ketobutyl)-5-methoxy-benzoic acid Formula: C17H23NO6 MolecularWeight: 337.36762

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC1=C(C=C(C=C1OC)C(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCC(=O)CC1=C(C=C(C=C1OC)C(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H23NO6/c1-6-11(19)9-12-13(18-16(22)24-17(2,3)4)7-10(15(20)21)8-14(12)23-5/h7-8H,6,9H2,1-5H3,(H,18,22)(H,20,21)