(E)-4-[[2-methyl-4-(propan-2-ylcarbamoyl)quinolin-3-yl]oxymethylamino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[2-methyl-4-(propan-2-ylcarbamoyl)quinolin-3-yl]oxymethylamino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[[4-(isopropylcarbamoyl)-2-methyl-3-quinolyl]oxymethylamino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[2-methyl-4-[oxo-(propan-2-ylamino)methyl]-3-quinolinyl]oxymethylamino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[[2-methyl-4-(propan-2-ylcarbamoyl)quinolin-3-yl]oxymethylamino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[[4-(isopropylcarbamoyl)-2-methyl-3-quinolyl]oxymethylamino]-4-keto-but-2-enoic acid Formula: C19H21N3O5 MolecularWeight: 371.38714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1OCNC(=O)C=CC(=O)O)C(=O)NC(C)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1OCNC(=O)/C=C/C(=O)O)C(=O)NC(C)C

InChI

InChI=1S/C19H21N3O5/c1-11(2)21-19(26)17-13-6-4-5-7-14(13)22-12(3)18(17)27-10-20-15(23)8-9-16(24)25/h4-9,11H,10H2,1-3H3,(H,20,23)(H,21,26)(H,24,25)/b9-8+