ethyl 2-[5-(2-bromophenyl)-1-(phenylsulfonyl)-3-propan-2-yl-pyrrol-2-yl]ethanoate

Systemtic Name: ethyl 2-[5-(2-bromophenyl)-1-(phenylsulfonyl)-3-propan-2-yl-pyrrol-2-yl]ethanoate Openeye Name: ethyl 2-[1-(benzenesulfonyl)-5-(2-bromophenyl)-3-isopropyl-pyrrol-2-yl]acetate CAS Name: 2-[1-(benzenesulfonyl)-5-(2-bromophenyl)-3-propan-2-yl-2-pyrrolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-(benzenesulfonyl)-5-(2-bromophenyl)-3-propan-2-ylpyrrol-2-yl]acetate Traditional Name: 2-[1-besyl-5-(2-bromophenyl)-3-isopropyl-pyrrol-2-yl]acetic acid ethyl ester Formula: C23H24BrNO4S MolecularWeight: 490.40996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C=C(N1S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3Br)C(C)C

Isomeric SMILES

CCOC(=O)CC1=C(C=C(N1S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3Br)C(C)C

InChI

InChI=1S/C23H24BrNO4S/c1-4-29-23(26)15-22-19(16(2)3)14-21(18-12-8-9-13-20(18)24)25(22)30(27,28)17-10-6-5-7-11-17/h5-14,16H,4,15H2,1-3H3