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

Systemtic Name: [4-(hydroxymethyl)-1-methyl-2,5-diphenyl-pyrrol-3-yl]methanol; methylcarbamic acid Openeye Name: [4-(hydroxymethyl)-1-methyl-2,5-diphenyl-pyrrol-3-yl]methanol; methylcarbamic acid CAS Name: [4-(hydroxymethyl)-1-methyl-2,5-diphenyl-3-pyrrolyl]methanol; methylcarbamic acid IUPAC Name: [4-(hydroxymethyl)-1-methyl-2,5-diphenylpyrrol-3-yl]methanol; methylcarbamic acid Traditional Name: methylcarbamic acid; (1-methyl-4-methylol-2,5-diphenyl-pyrrol-3-yl)methanol Formula: C23H29N3O6 MolecularWeight: 443.49286

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)O.CNC(=O)O.CN1C(=C(C(=C1C2=CC=CC=C2)CO)CO)C3=CC=CC=C3

Isomeric SMILES

CNC(=O)O.CNC(=O)O.CN1C(=C(C(=C1C2=CC=CC=C2)CO)CO)C3=CC=CC=C3

InChI

InChI=1S/C19H19NO2.2C2H5NO2/c1-20-18(14-8-4-2-5-9-14)16(12-21)17(13-22)19(20)15-10-6-3-7-11-15;2*1-3-2(4)5/h2-11,21-22H,12-13H2,1H3;2*3H,1H3,(H,4,5)