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

Systemtic Name: 3-(6-nitro-1H-benzimidazol-2-yl)-8-prop-2-enyl-chromen-2-one Openeye Name: 8-allyl-3-(6-nitro-1H-benzimidazol-2-yl)chromen-2-one CAS Name: 3-(6-nitro-1H-benzimidazol-2-yl)-8-prop-2-enyl-1-benzopyran-2-one IUPAC Name: 3-(6-nitro-1H-benzimidazol-2-yl)-8-prop-2-enylchromen-2-one Traditional Name: 8-allyl-3-(6-nitro-1H-benzimidazol-2-yl)coumarin Formula: C19H13N3O4 MolecularWeight: 347.32422

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC2=C1OC(=O)C(=C2)C3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C=CCC1=CC=CC2=C1OC(=O)C(=C2)C3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H13N3O4/c1-2-4-11-5-3-6-12-9-14(19(23)26-17(11)12)18-20-15-8-7-13(22(24)25)10-16(15)21-18/h2-3,5-10H,1,4H2,(H,20,21)