methyl 2-[2-methoxyethanoyl(prop-2-enyl)amino]-4-nitro-benzoate

Systemtic Name: methyl 2-[2-methoxyethanoyl(prop-2-enyl)amino]-4-nitro-benzoate Openeye Name: methyl 2-[allyl-(2-methoxyacetyl)amino]-4-nitro-benzoate CAS Name: 2-[(2-methoxy-1-oxoethyl)-prop-2-enylamino]-4-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-[(2-methoxyacetyl)-prop-2-enylamino]-4-nitrobenzoate Traditional Name: 2-[allyl-(2-methoxyacetyl)amino]-4-nitro-benzoic acid methyl ester Formula: C14H16N2O6 MolecularWeight: 308.28664

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N(CC=C)C1=C(C=CC(=C1)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COCC(=O)N(CC=C)C1=C(C=CC(=C1)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C14H16N2O6/c1-4-7-15(13(17)9-21-2)12-8-10(16(19)20)5-6-11(12)14(18)22-3/h4-6,8H,1,7,9H2,2-3H3