methyl 7-nitro-2-(phenylmethyl)-1,3-benzoxazole-5-carboxylate

Systemtic Name: methyl 7-nitro-2-(phenylmethyl)-1,3-benzoxazole-5-carboxylate Openeye Name: methyl 2-benzyl-7-nitro-1,3-benzoxazole-5-carboxylate CAS Name: 7-nitro-2-(phenylmethyl)-1,3-benzoxazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-benzyl-7-nitro-1,3-benzoxazole-5-carboxylate Traditional Name: 2-benzyl-7-nitro-1,3-benzoxazole-5-carboxylic acid methyl ester Formula: C16H12N2O5 MolecularWeight: 312.27688

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C(=C1)[N+](=O)[O-])OC(=N2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC2=C(C(=C1)[N+](=O)[O-])OC(=N2)CC3=CC=CC=C3

InChI

InChI=1S/C16H12N2O5/c1-22-16(19)11-8-12-15(13(9-11)18(20)21)23-14(17-12)7-10-5-3-2-4-6-10/h2-6,8-9H,7H2,1H3