ethyl 2-[4-[(5-bromanyl-7-methyl-3-propan-2-yl-2,3-dihydroindol-1-yl)sulfonyl]-2-methyl-phenyl]ethanoate

Systemtic Name: ethyl 2-[4-[(5-bromanyl-7-methyl-3-propan-2-yl-2,3-dihydroindol-1-yl)sulfonyl]-2-methyl-phenyl]ethanoate Openeye Name: ethyl 2-[4-(5-bromo-3-isopropyl-7-methyl-indolin-1-yl)sulfonyl-2-methyl-phenyl]acetate CAS Name: 2-[4-[(5-bromo-7-methyl-3-propan-2-yl-2,3-dihydroindol-1-yl)sulfonyl]-2-methylphenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(5-bromo-7-methyl-3-propan-2-yl-2,3-dihydroindol-1-yl)sulfonyl]-2-methylphenyl]acetate Traditional Name: 2-[4-(5-bromo-3-isopropyl-7-methyl-indolin-1-yl)sulfonyl-2-methyl-phenyl]acetic acid ethyl ester Formula: C23H28BrNO4S MolecularWeight: 494.44172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C=C(C=C1)S(=O)(=O)N2CC(C3=CC(=CC(=C32)C)Br)C(C)C)C

Isomeric SMILES

CCOC(=O)CC1=C(C=C(C=C1)S(=O)(=O)N2CC(C3=CC(=CC(=C32)C)Br)C(C)C)C

InChI

InChI=1S/C23H28BrNO4S/c1-6-29-22(26)11-17-7-8-19(10-15(17)4)30(27,28)25-13-21(14(2)3)20-12-18(24)9-16(5)23(20)25/h7-10,12,14,21H,6,11,13H2,1-5H3