ethyl 2-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(4-nitrophenyl)-5-[(Z)-3-oxidanylidene-2-phenyl-prop-1-enyl]pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(4-nitrophenyl)-5-[(Z)-3-oxidanylidene-2-phenyl-prop-1-enyl]pyrrole-3-carboxylate Openeye Name: ethyl 1-(tert-butoxycarbonylamino)-2-methyl-4-(4-nitrophenyl)-5-[(Z)-3-oxo-2-phenyl-prop-1-enyl]pyrrole-3-carboxylate CAS Name: 2-methyl-1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-(4-nitrophenyl)-5-[(Z)-3-oxo-2-phenylprop-1-enyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(4-nitrophenyl)-5-[(Z)-3-oxo-2-phenylprop-1-enyl]pyrrole-3-carboxylate Traditional Name: 1-(tert-butoxycarbonylamino)-5-[(Z)-3-keto-2-phenyl-prop-1-enyl]-2-methyl-4-(4-nitrophenyl)pyrrole-3-carboxylic acid ethyl ester Formula: C28H29N3O7 MolecularWeight: 519.54576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C2=CC=C(C=C2)[N+](=O)[O-])C=C(C=O)C3=CC=CC=C3)NC(=O)OC(C)(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C2=CC=C(C=C2)[N+](=O)[O-])/C=C(\C=O)/C3=CC=CC=C3)NC(=O)OC(C)(C)C)C

InChI

InChI=1S/C28H29N3O7/c1-6-37-26(33)24-18(2)30(29-27(34)38-28(3,4)5)23(16-21(17-32)19-10-8-7-9-11-19)25(24)20-12-14-22(15-13-20)31(35)36/h7-17H,6H2,1-5H3,(H,29,34)/b21-16+