(E)-3-(4-nitrophenyl)-1-[2-[(1R)-1-oxidanylethyl]benzimidazol-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-nitrophenyl)-1-[2-[(1R)-1-oxidanylethyl]benzimidazol-1-yl]prop-2-en-1-one Openeye Name: (E)-1-[2-[(1R)-1-hydroxyethyl]benzimidazol-1-yl]-3-(4-nitrophenyl)prop-2-en-1-one CAS Name: (E)-1-[2-[(1R)-1-hydroxyethyl]-1-benzimidazolyl]-3-(4-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-[2-[(1R)-1-hydroxyethyl]benzimidazol-1-yl]-3-(4-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-[2-[(1R)-1-hydroxyethyl]benzimidazol-1-yl]-3-(4-nitrophenyl)prop-2-en-1-one Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2N1C(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2N1C(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C18H15N3O4/c1-12(22)18-19-15-4-2-3-5-16(15)20(18)17(23)11-8-13-6-9-14(10-7-13)21(24)25/h2-12,22H,1H3/b11-8+/t12-/m1/s1