(E)-4-[4-(4-methylpentylamino)phenyl]peroxy-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[4-(4-methylpentylamino)phenyl]peroxy-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[4-(isohexylamino)phenyl]peroxy-4-oxo-but-2-enoic acid CAS Name: (E)-4-[4-(4-methylpentylamino)phenyl]dioxy-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[4-(4-methylpentylamino)phenyl]peroxy-4-oxobut-2-enoic acid Traditional Name: (E)-4-[4-(isohexylamino)phenyl]peroxy-4-keto-but-2-enoic acid Formula: C16H21NO5 MolecularWeight: 307.34164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCNC1=CC=C(C=C1)OOC(=O)C=CC(=O)O

Isomeric SMILES

CC(C)CCCNC1=CC=C(C=C1)OOC(=O)/C=C/C(=O)O

InChI

InChI=1S/C16H21NO5/c1-12(2)4-3-11-17-13-5-7-14(8-6-13)21-22-16(20)10-9-15(18)19/h5-10,12,17H,3-4,11H2,1-2H3,(H,18,19)/b10-9+