(4E)-4-[4-(1-adamantylcarbonylamino)phenyl]-4-hydroxyimino-butanoic acid

Systemtic Name: (4E)-4-[4-(1-adamantylcarbonylamino)phenyl]-4-hydroxyimino-butanoic acid Openeye Name: (4E)-4-[4-(adamantane-1-carbonylamino)phenyl]-4-hydroxyimino-butanoic acid CAS Name: (4E)-4-[4-[[1-adamantyl(oxo)methyl]amino]phenyl]-4-hydroxyiminobutanoic acid IUPAC Name: (4E)-4-[4-(adamantane-1-carbonylamino)phenyl]-4-hydroxyiminobutanoic acid Traditional Name: (4E)-4-[4-(adamantane-1-carbonylamino)phenyl]-4-hydroximino-butyric acid Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC=C(C=C4)C(=NO)CCC(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC=C(C=C4)/C(=N/O)/CCC(=O)O

InChI

InChI=1S/C21H26N2O4/c24-19(25)6-5-18(23-27)16-1-3-17(4-2-16)22-20(26)21-10-13-7-14(11-21)9-15(8-13)12-21/h1-4,13-15,27H,5-12H2,(H,22,26)(H,24,25)/b23-18+