N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-6-nitro-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-6-nitro-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-6-nitro-2-oxo-chromene-3-carboxamide CAS Name: N-[(1R)-1-[4-(1-imidazolyl)phenyl]ethyl]-6-nitro-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-6-nitro-2-oxochromene-3-carboxamide Traditional Name: N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-2-keto-6-nitro-chromene-3-carboxamide Formula: C21H16N4O5 MolecularWeight: 404.37554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)C3=CC4=C(C=CC(=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)N2C=CN=C2)NC(=O)C3=CC4=C(C=CC(=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C21H16N4O5/c1-13(14-2-4-16(5-3-14)24-9-8-22-12-24)23-20(26)18-11-15-10-17(25(28)29)6-7-19(15)30-21(18)27/h2-13H,1H3,(H,23,26)/t13-/m1/s1