methyl 3-[(4-hydroxyphenyl)methylcarbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[(4-hydroxyphenyl)methylcarbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[(4-hydroxyphenyl)methylcarbamoyl]-5-nitro-benzoate CAS Name: 3-[[(4-hydroxyphenyl)methylamino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[(4-hydroxyphenyl)methylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-[(4-hydroxybenzyl)carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C16H14N2O6 MolecularWeight: 330.29216

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)NCC2=CC=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)NCC2=CC=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O6/c1-24-16(21)12-6-11(7-13(8-12)18(22)23)15(20)17-9-10-2-4-14(19)5-3-10/h2-8,19H,9H2,1H3,(H,17,20)