3-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]-5-nitro-1,3-benzoxazol-2-one

Systemtic Name: 3-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]-5-nitro-1,3-benzoxazol-2-one Openeye Name: 3-[2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]-5-nitro-1,3-benzoxazol-2-one CAS Name: 3-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]-5-nitro-1,3-benzoxazol-2-one IUPAC Name: 3-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]-5-nitro-1,3-benzoxazol-2-one Traditional Name: 3-[2-keto-2-(2-methyl-1H-indol-3-yl)ethyl]-5-nitro-1,3-benzoxazol-2-one Formula: C18H13N3O5 MolecularWeight: 351.31292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)CN3C4=C(C=CC(=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)CN3C4=C(C=CC(=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C18H13N3O5/c1-10-17(12-4-2-3-5-13(12)19-10)15(22)9-20-14-8-11(21(24)25)6-7-16(14)26-18(20)23/h2-8,19H,9H2,1H3