3-(1H-benzimidazol-2-yl)-8-nitro-6-(phenylmethyl)chromen-2-one

Systemtic Name: 3-(1H-benzimidazol-2-yl)-8-nitro-6-(phenylmethyl)chromen-2-one Openeye Name: 3-(1H-benzimidazol-2-yl)-6-benzyl-8-nitro-chromen-2-one CAS Name: 3-(1H-benzimidazol-2-yl)-8-nitro-6-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-(1H-benzimidazol-2-yl)-6-benzyl-8-nitrochromen-2-one Traditional Name: 3-(1H-benzimidazol-2-yl)-6-benzyl-8-nitro-coumarin Formula: C23H15N3O4 MolecularWeight: 397.3829

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=C3C(=C2)C=C(C(=O)O3)C4=NC5=CC=CC=C5N4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=C3C(=C2)C=C(C(=O)O3)C4=NC5=CC=CC=C5N4)[N+](=O)[O-]

InChI

InChI=1S/C23H15N3O4/c27-23-17(22-24-18-8-4-5-9-19(18)25-22)13-16-11-15(10-14-6-2-1-3-7-14)12-20(26(28)29)21(16)30-23/h1-9,11-13H,10H2,(H,24,25)