butyl 4-[[(E)-2-(1,3-benzoxazol-2-yl)-3-oxidanylidene-prop-1-enyl]amino]benzoate

Systemtic Name: butyl 4-[[(E)-2-(1,3-benzoxazol-2-yl)-3-oxidanylidene-prop-1-enyl]amino]benzoate Openeye Name: butyl 4-[[(E)-2-(1,3-benzoxazol-2-yl)-3-oxo-prop-1-enyl]amino]benzoate CAS Name: 4-[[(E)-2-(1,3-benzoxazol-2-yl)-3-oxoprop-1-enyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[(E)-2-(1,3-benzoxazol-2-yl)-3-oxoprop-1-enyl]amino]benzoate Traditional Name: 4-[[(E)-2-(1,3-benzoxazol-2-yl)-3-keto-prop-1-enyl]amino]benzoic acid butyl ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC=C(C=O)C2=NC3=CC=CC=C3O2

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)N/C=C(/C=O)\C2=NC3=CC=CC=C3O2

InChI

InChI=1S/C21H20N2O4/c1-2-3-12-26-21(25)15-8-10-17(11-9-15)22-13-16(14-24)20-23-18-6-4-5-7-19(18)27-20/h4-11,13-14,22H,2-3,12H2,1H3/b16-13-