(4-methyl-3-nitro-phenyl)methyl 5-oxidanyl-1H-indole-2-carboxylate

Systemtic Name: (4-methyl-3-nitro-phenyl)methyl 5-oxidanyl-1H-indole-2-carboxylate Openeye Name: (4-methyl-3-nitro-phenyl)methyl 5-hydroxy-1H-indole-2-carboxylate CAS Name: 5-hydroxy-1H-indole-2-carboxylic acid (4-methyl-3-nitrophenyl)methyl ester IUPAC Name: (4-methyl-3-nitrophenyl)methyl 5-hydroxy-1H-indole-2-carboxylate Traditional Name: 5-hydroxy-1H-indole-2-carboxylic acid (4-methyl-3-nitro-benzyl) ester Formula: C17H14N2O5 MolecularWeight: 326.30346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)COC(=O)C2=CC3=C(N2)C=CC(=C3)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)COC(=O)C2=CC3=C(N2)C=CC(=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O5/c1-10-2-3-11(6-16(10)19(22)23)9-24-17(21)15-8-12-7-13(20)4-5-14(12)18-15/h2-8,18,20H,9H2,1H3