(E)-2-(1,3-benzoxazol-2-yl)-3-[(4-ethanoylphenyl)amino]prop-2-enal

Systemtic Name: (E)-2-(1,3-benzoxazol-2-yl)-3-[(4-ethanoylphenyl)amino]prop-2-enal Openeye Name: (E)-3-(4-acetylanilino)-2-(1,3-benzoxazol-2-yl)prop-2-enal CAS Name: (E)-3-(4-acetylanilino)-2-(1,3-benzoxazol-2-yl)-2-propenal IUPAC Name: (E)-3-(4-acetylanilino)-2-(1,3-benzoxazol-2-yl)prop-2-enal Traditional Name: (E)-3-(4-acetylanilino)-2-(1,3-benzoxazol-2-yl)acrolein Formula: C18H14N2O3 MolecularWeight: 306.31536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N2O3/c1-12(22)13-6-8-15(9-7-13)19-10-14(11-21)18-20-16-4-2-3-5-17(16)23-18/h2-11,19H,1H3/b14-10-