molecular hydrogen; (phenylmethyl) 5-[(5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-1H-pyrrole-2-carboxylate

Systemtic Name: molecular hydrogen; (phenylmethyl) 5-[(5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-1H-pyrrole-2-carboxylate Openeye Name: benzyl 5-[(5-benzyloxycarbonyl-1H-pyrrol-2-yl)methyl]-1H-pyrrole-2-carboxylate; molecular hydrogen CAS Name: molecular hydrogen; 5-[(5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-[(5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-1H-pyrrole-2-carboxylate; molecular hydrogen Traditional Name: 5-[(5-carbobenzoxy-1H-pyrrol-2-yl)methyl]-1H-pyrrole-2-carboxylic acid benzyl ester; molecular hydrogen Formula: C25H24N2O4 MolecularWeight: 416.46906

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Descriptors Computed from Structure

Canonical SMILES:

[HH].C1=CC=C(C=C1)COC(=O)C2=CC=C(N2)CC3=CC=C(N3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

[HH].C1=CC=C(C=C1)COC(=O)C2=CC=C(N2)CC3=CC=C(N3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H22N2O4.H2/c28-24(30-16-18-7-3-1-4-8-18)22-13-11-20(26-22)15-21-12-14-23(27-21)25(29)31-17-19-9-5-2-6-10-19;/h1-14,26-27H,15-17H2;1H