[2-(hydroxymethyl)-1,4,5-triphenyl-pyrrol-3-yl]methanol; methylcarbamic acid

Systemtic Name: [2-(hydroxymethyl)-1,4,5-triphenyl-pyrrol-3-yl]methanol; methylcarbamic acid Openeye Name: [2-(hydroxymethyl)-1,4,5-triphenyl-pyrrol-3-yl]methanol; methylcarbamic acid CAS Name: [2-(hydroxymethyl)-1,4,5-triphenyl-3-pyrrolyl]methanol; methylcarbamic acid IUPAC Name: [2-(hydroxymethyl)-1,4,5-triphenylpyrrol-3-yl]methanol; methylcarbamic acid Traditional Name: methylcarbamic acid; (2-methylol-1,4,5-triphenyl-pyrrol-3-yl)methanol Formula: C28H31N3O6 MolecularWeight: 505.56224

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)O.CNC(=O)O.C1=CC=C(C=C1)C2=C(N(C(=C2CO)CO)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CNC(=O)O.CNC(=O)O.C1=CC=C(C=C1)C2=C(N(C(=C2CO)CO)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H21NO2.2C2H5NO2/c26-16-21-22(17-27)25(20-14-8-3-9-15-20)24(19-12-6-2-7-13-19)23(21)18-10-4-1-5-11-18;2*1-3-2(4)5/h1-15,26-27H,16-17H2;2*3H,1H3,(H,4,5)