6-[2-(4-dimethylaminophenyl)ethylcarbamoylamino]-2-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid

Systemtic Name: 6-[2-(4-dimethylaminophenyl)ethylcarbamoylamino]-2-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid Openeye Name: 3-(tert-butoxycarbonylamino)-6-[2-(4-dimethylaminophenyl)ethylcarbamoylamino]-2-methyl-benzoic acid CAS Name: 6-[[[2-(4-dimethylaminophenyl)ethylamino]-oxomethyl]amino]-2-methyl-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]benzoic acid IUPAC Name: 6-[2-(4-dimethylaminophenyl)ethylcarbamoylamino]-2-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid Traditional Name: 3-(tert-butoxycarbonylamino)-6-[2-(4-dimethylaminophenyl)ethylcarbamoylamino]-2-methyl-benzoic acid Formula: C24H32N4O5 MolecularWeight: 456.53468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C(=O)O)NC(=O)NCCC2=CC=C(C=C2)N(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1C(=O)O)NC(=O)NCCC2=CC=C(C=C2)N(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C24H32N4O5/c1-15-18(27-23(32)33-24(2,3)4)11-12-19(20(15)21(29)30)26-22(31)25-14-13-16-7-9-17(10-8-16)28(5)6/h7-12H,13-14H2,1-6H3,(H,27,32)(H,29,30)(H2,25,26,31)