(E)-N-(2-carboxy-4-methyl-phenyl)-3-[4-(diethylamino)phenyl]prop-2-en-1-imine oxide

Systemtic Name: (E)-N-(2-carboxy-4-methyl-phenyl)-3-[4-(diethylamino)phenyl]prop-2-en-1-imine oxide Openeye Name: (E)-N-(2-carboxy-4-methyl-phenyl)-3-[4-(diethylamino)phenyl]prop-2-en-1-imine oxide CAS Name: (E)-N-(2-carboxy-4-methylphenyl)-3-[4-(diethylamino)phenyl]-2-propen-1-imine oxide IUPAC Name: (E)-N-(2-carboxy-4-methylphenyl)-3-[4-(diethylamino)phenyl]prop-2-en-1-imine oxide Traditional Name: (E)-N-(2-carboxy-4-methyl-phenyl)-3-[4-(diethylamino)phenyl]prop-2-en-1-imine oxide Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C=CC=[N+](C2=C(C=C(C=C2)C)C(=O)O)[O-]

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)/C=C/C=[N+](/C2=C(C=C(C=C2)C)C(=O)O)\[O-]

InChI

InChI=1S/C21H24N2O3/c1-4-22(5-2)18-11-9-17(10-12-18)7-6-14-23(26)20-13-8-16(3)15-19(20)21(24)25/h6-15H,4-5H2,1-3H3,(H,24,25)/b7-6+,23-14-