(E)-2-(5-chloranyl-1,3-benzoxazol-2-yl)-3-[(4-nitrophenyl)amino]prop-2-enal

Systemtic Name: (E)-2-(5-chloranyl-1,3-benzoxazol-2-yl)-3-[(4-nitrophenyl)amino]prop-2-enal Openeye Name: (E)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-(4-nitroanilino)prop-2-enal CAS Name: (E)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-(4-nitroanilino)-2-propenal IUPAC Name: (E)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-(4-nitroanilino)prop-2-enal Traditional Name: (E)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-(4-nitroanilino)acrolein Formula: C16H10ClN3O4 MolecularWeight: 343.7213

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC=C(C=O)C2=NC3=C(O2)C=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1N/C=C(/C=O)\C2=NC3=C(O2)C=CC(=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H10ClN3O4/c17-11-1-6-15-14(7-11)19-16(24-15)10(9-21)8-18-12-2-4-13(5-3-12)20(22)23/h1-9,18H/b10-8-