3-(2-methyl-5-nitro-imidazol-1-yl)carbonyl-8-prop-2-enyl-chromen-2-one

Systemtic Name: 3-(2-methyl-5-nitro-imidazol-1-yl)carbonyl-8-prop-2-enyl-chromen-2-one Openeye Name: 8-allyl-3-(2-methyl-5-nitro-imidazole-1-carbonyl)chromen-2-one CAS Name: 3-[(2-methyl-5-nitro-1-imidazolyl)-oxomethyl]-8-prop-2-enyl-1-benzopyran-2-one IUPAC Name: 3-(2-methyl-5-nitroimidazole-1-carbonyl)-8-prop-2-enylchromen-2-one Traditional Name: 8-allyl-3-(2-methyl-5-nitro-imidazole-1-carbonyl)coumarin Formula: C17H13N3O5 MolecularWeight: 339.30222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1C(=O)C2=CC3=C(C(=CC=C3)CC=C)OC2=O)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1C(=O)C2=CC3=C(C(=CC=C3)CC=C)OC2=O)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O5/c1-3-5-11-6-4-7-12-8-13(17(22)25-15(11)12)16(21)19-10(2)18-9-14(19)20(23)24/h3-4,6-9H,1,5H2,2H3