2-[7-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butylcarbamoyl]-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]ethanoic acid

Systemtic Name: 2-[7-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butylcarbamoyl]-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]ethanoic acid Openeye Name: 2-[7-[4-(tert-butoxycarbonylamino)butylcarbamoyl]-2-oxo-3,4-dihydro-1H-quinolin-3-yl]acetic acid CAS Name: 2-[7-[[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butylamino]-oxomethyl]-2-oxo-3,4-dihydro-1H-quinolin-3-yl]acetic acid IUPAC Name: 2-[7-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butylcarbamoyl]-2-oxo-3,4-dihydro-1H-quinolin-3-yl]acetic acid Traditional Name: 2-[7-[4-(tert-butoxycarbonylamino)butylcarbamoyl]-2-keto-3,4-dihydro-1H-quinolin-3-yl]acetic acid Formula: C21H29N3O6 MolecularWeight: 419.47146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCNC(=O)C1=CC2=C(CC(C(=O)N2)CC(=O)O)C=C1

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCNC(=O)C1=CC2=C(CC(C(=O)N2)CC(=O)O)C=C1

InChI

InChI=1S/C21H29N3O6/c1-21(2,3)30-20(29)23-9-5-4-8-22-18(27)14-7-6-13-10-15(12-17(25)26)19(28)24-16(13)11-14/h6-7,11,15H,4-5,8-10,12H2,1-3H3,(H,22,27)(H,23,29)(H,24,28)(H,25,26)