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

Systemtic Name: (E)-2-(5-chloranyl-1,3-benzoxazol-2-yl)-3-[(2-methyl-4-nitro-phenyl)amino]prop-2-enal Openeye Name: (E)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-(2-methyl-4-nitro-anilino)prop-2-enal CAS Name: (E)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-(2-methyl-4-nitroanilino)-2-propenal IUPAC Name: (E)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-(2-methyl-4-nitroanilino)prop-2-enal Traditional Name: (E)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-(2-methyl-4-nitro-anilino)acrolein Formula: C17H12ClN3O4 MolecularWeight: 357.74788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC=C(C=O)C2=NC3=C(O2)C=CC(=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])N/C=C(/C=O)\C2=NC3=C(O2)C=CC(=C3)Cl

InChI

InChI=1S/C17H12ClN3O4/c1-10-6-13(21(23)24)3-4-14(10)19-8-11(9-22)17-20-15-7-12(18)2-5-16(15)25-17/h2-9,19H,1H3/b11-8-