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

Systemtic Name: 7-methoxy-2-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]methylamino]quinoline-3-carboxylic acid Openeye Name: 2-[[4-(tert-butoxycarbonylamino)phenyl]methylamino]-7-methoxy-quinoline-3-carboxylic acid CAS Name: 7-methoxy-2-[[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]methylamino]-3-quinolinecarboxylic acid IUPAC Name: 7-methoxy-2-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]methylamino]quinoline-3-carboxylic acid Traditional Name: 2-[[4-(tert-butoxycarbonylamino)benzyl]amino]-7-methoxy-quinoline-3-carboxylic acid Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)CNC2=C(C=C3C=CC(=CC3=N2)OC)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)CNC2=C(C=C3C=CC(=CC3=N2)OC)C(=O)O

InChI

InChI=1S/C23H25N3O5/c1-23(2,3)31-22(29)25-16-8-5-14(6-9-16)13-24-20-18(21(27)28)11-15-7-10-17(30-4)12-19(15)26-20/h5-12H,13H2,1-4H3,(H,24,26)(H,25,29)(H,27,28)