O2-ethyl O4-(phenylmethyl) 5-(5-ethoxycarbonyl-3-phenylmethoxycarbonyl-4-propyl-1H-pyrrol-2-yl)-3-propyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-ethyl O4-(phenylmethyl) 5-(5-ethoxycarbonyl-3-phenylmethoxycarbonyl-4-propyl-1H-pyrrol-2-yl)-3-propyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-benzyl O2-ethyl 5-(3-benzyloxycarbonyl-5-ethoxycarbonyl-4-propyl-1H-pyrrol-2-yl)-3-propyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-(5-ethoxycarbonyl-3-phenylmethoxycarbonyl-4-propyl-1H-pyrrol-2-yl)-3-propyl-1H-pyrrole-2,4-dicarboxylic acid O2-ethyl ester O4-(phenylmethyl) ester IUPAC Name: 4-O-benzyl 2-O-ethyl 5-(5-ethoxycarbonyl-3-phenylmethoxycarbonyl-4-propyl-1H-pyrrol-2-yl)-3-propyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-(5-carbethoxy-3-carbobenzoxy-4-propyl-1H-pyrrol-2-yl)-3-propyl-1H-pyrrole-2,4-dicarboxylic acid O4-benzyl ester O2-ethyl ester Formula: C36H40N2O8 MolecularWeight: 628.7114

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(NC(=C1C(=O)OCC2=CC=CC=C2)C3=C(C(=C(N3)C(=O)OCC)CCC)C(=O)OCC4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCCC1=C(NC(=C1C(=O)OCC2=CC=CC=C2)C3=C(C(=C(N3)C(=O)OCC)CCC)C(=O)OCC4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C36H40N2O8/c1-5-15-25-27(33(39)45-21-23-17-11-9-12-18-23)31(37-29(25)35(41)43-7-3)32-28(34(40)46-22-24-19-13-10-14-20-24)26(16-6-2)30(38-32)36(42)44-8-4/h9-14,17-20,37-38H,5-8,15-16,21-22H2,1-4H3