(E)-4-[[3-(3-methylbutoxy)phenyl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[3-(3-methylbutoxy)phenyl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(3-isopentyloxyanilino)-4-oxo-but-2-enoic acid CAS Name: (E)-4-[3-(3-methylbutoxy)anilino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[3-(3-methylbutoxy)anilino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-(3-isoamoxyanilino)-4-keto-but-2-enoic acid Formula: C15H19NO4 MolecularWeight: 277.31566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)NC(=O)C=CC(=O)O

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C15H19NO4/c1-11(2)8-9-20-13-5-3-4-12(10-13)16-14(17)6-7-15(18)19/h3-7,10-11H,8-9H2,1-2H3,(H,16,17)(H,18,19)/b7-6+