methyl (2S)-4-ethenyl-1-(4-methyl-2-nitro-3-phenylmethoxy-phenyl)carbonyl-2,5-dihydropyrrole-2-carboxylate

Systemtic Name: methyl (2S)-4-ethenyl-1-(4-methyl-2-nitro-3-phenylmethoxy-phenyl)carbonyl-2,5-dihydropyrrole-2-carboxylate Openeye Name: methyl (2S)-1-(3-benzyloxy-4-methyl-2-nitro-benzoyl)-4-vinyl-2,5-dihydropyrrole-2-carboxylate CAS Name: (2S)-4-ethenyl-1-[(4-methyl-2-nitro-3-phenylmethoxyphenyl)-oxomethyl]-2,5-dihydropyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl (2S)-4-ethenyl-1-(4-methyl-2-nitro-3-phenylmethoxybenzoyl)-2,5-dihydropyrrole-2-carboxylate Traditional Name: (2S)-1-(3-benzoxy-4-methyl-2-nitro-benzoyl)-4-vinyl-3-pyrroline-2-carboxylic acid methyl ester Formula: C23H22N2O6 MolecularWeight: 422.43058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)N2CC(=CC2C(=O)OC)C=C)[N+](=O)[O-])OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)N2CC(=C[C@H]2C(=O)OC)C=C)[N+](=O)[O-])OCC3=CC=CC=C3

InChI

InChI=1S/C23H22N2O6/c1-4-16-12-19(23(27)30-3)24(13-16)22(26)18-11-10-15(2)21(20(18)25(28)29)31-14-17-8-6-5-7-9-17/h4-12,19H,1,13-14H2,2-3H3/t19-/m0/s1