7-methoxy-2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butylamino]quinoline-3-carboxylic acid

Systemtic Name: 7-methoxy-2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butylamino]quinoline-3-carboxylic acid Openeye Name: 2-[4-(tert-butoxycarbonylamino)butylamino]-7-methoxy-quinoline-3-carboxylic acid CAS Name: 7-methoxy-2-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butylamino]-3-quinolinecarboxylic acid IUPAC Name: 7-methoxy-2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butylamino]quinoline-3-carboxylic acid Traditional Name: 2-[4-(tert-butoxycarbonylamino)butylamino]-7-methoxy-quinoline-3-carboxylic acid Formula: C20H27N3O5 MolecularWeight: 389.44548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCNC1=C(C=C2C=CC(=CC2=N1)OC)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCNC1=C(C=C2C=CC(=CC2=N1)OC)C(=O)O

InChI

InChI=1S/C20H27N3O5/c1-20(2,3)28-19(26)22-10-6-5-9-21-17-15(18(24)25)11-13-7-8-14(27-4)12-16(13)23-17/h7-8,11-12H,5-6,9-10H2,1-4H3,(H,21,23)(H,22,26)(H,24,25)