2-[1-(phenylmethyl)-4-propan-2-ylsulfonyl-pyrrol-3-yl]phenol

Systemtic Name: 2-[1-(phenylmethyl)-4-propan-2-ylsulfonyl-pyrrol-3-yl]phenol Openeye Name: 2-(1-benzyl-4-isopropylsulfonyl-pyrrol-3-yl)phenol CAS Name: 2-[1-(phenylmethyl)-4-propan-2-ylsulfonyl-3-pyrrolyl]phenol IUPAC Name: 2-(1-benzyl-4-propan-2-ylsulfonylpyrrol-3-yl)phenol Traditional Name: 2-(1-benzyl-4-isopropylsulfonyl-pyrrol-3-yl)phenol Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CN(C=C1C2=CC=CC=C2O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)S(=O)(=O)C1=CN(C=C1C2=CC=CC=C2O)CC3=CC=CC=C3

InChI

InChI=1S/C20H21NO3S/c1-15(2)25(23,24)20-14-21(12-16-8-4-3-5-9-16)13-18(20)17-10-6-7-11-19(17)22/h3-11,13-15,22H,12H2,1-2H3