4-[[(2E)-2-[3-tert-butyl-4-(diethylamino)phenyl]-2-hydroxyimino-ethanoyl]amino]benzoic acid

Systemtic Name: 4-[[(2E)-2-[3-tert-butyl-4-(diethylamino)phenyl]-2-hydroxyimino-ethanoyl]amino]benzoic acid Openeye Name: 4-[[(2E)-2-[3-tert-butyl-4-(diethylamino)phenyl]-2-hydroxyimino-acetyl]amino]benzoic acid CAS Name: 4-[[(2E)-2-[3-tert-butyl-4-(diethylamino)phenyl]-2-hydroxyimino-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-[[(2E)-2-[3-tert-butyl-4-(diethylamino)phenyl]-2-hydroxyiminoacetyl]amino]benzoic acid Traditional Name: 4-[[(2E)-2-[3-tert-butyl-4-(diethylamino)phenyl]-2-hydroximino-acetyl]amino]benzoic acid Formula: C23H29N3O4 MolecularWeight: 411.49406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)C(=NO)C(=O)NC2=CC=C(C=C2)C(=O)O)C(C)(C)C

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)/C(=N\O)/C(=O)NC2=CC=C(C=C2)C(=O)O)C(C)(C)C

InChI

InChI=1S/C23H29N3O4/c1-6-26(7-2)19-13-10-16(14-18(19)23(3,4)5)20(25-30)21(27)24-17-11-8-15(9-12-17)22(28)29/h8-14,30H,6-7H2,1-5H3,(H,24,27)(H,28,29)/b25-20+