ethyl 2-[2-bromanyl-5-(4-methylphenyl)sulfonyl-6H-phenanthridin-6-yl]ethanoate

Systemtic Name: ethyl 2-[2-bromanyl-5-(4-methylphenyl)sulfonyl-6H-phenanthridin-6-yl]ethanoate Openeye Name: ethyl 2-[2-bromo-5-(p-tolylsulfonyl)-6H-phenanthridin-6-yl]acetate CAS Name: 2-[2-bromo-5-(4-methylphenyl)sulfonyl-6H-phenanthridin-6-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-bromo-5-(4-methylphenyl)sulfonyl-6H-phenanthridin-6-yl]acetate Traditional Name: 2-(2-bromo-5-tosyl-6H-phenanthridin-6-yl)acetic acid ethyl ester Formula: C24H22BrNO4S MolecularWeight: 500.40478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C2=CC=CC=C2C3=C(N1S(=O)(=O)C4=CC=C(C=C4)C)C=CC(=C3)Br

Isomeric SMILES

CCOC(=O)CC1C2=CC=CC=C2C3=C(N1S(=O)(=O)C4=CC=C(C=C4)C)C=CC(=C3)Br

InChI

InChI=1S/C24H22BrNO4S/c1-3-30-24(27)15-23-20-7-5-4-6-19(20)21-14-17(25)10-13-22(21)26(23)31(28,29)18-11-8-16(2)9-12-18/h4-14,23H,3,15H2,1-2H3