methyl 3-[4,6-dimethyl-1-(4-nitrophenyl)-3-(phenylsulfonyl)-5-propan-2-yl-indol-2-yl]propanoate

Systemtic Name: methyl 3-[4,6-dimethyl-1-(4-nitrophenyl)-3-(phenylsulfonyl)-5-propan-2-yl-indol-2-yl]propanoate Openeye Name: methyl 3-[3-(benzenesulfonyl)-5-isopropyl-4,6-dimethyl-1-(4-nitrophenyl)indol-2-yl]propanoate CAS Name: 3-[3-(benzenesulfonyl)-4,6-dimethyl-1-(4-nitrophenyl)-5-propan-2-yl-2-indolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-(benzenesulfonyl)-4,6-dimethyl-1-(4-nitrophenyl)-5-propan-2-ylindol-2-yl]propanoate Traditional Name: 3-[3-besyl-5-isopropyl-4,6-dimethyl-1-(4-nitrophenyl)indol-2-yl]propionic acid methyl ester Formula: C29H30N2O6S MolecularWeight: 534.6233

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1C(C)C)C)C(=C(N2C3=CC=C(C=C3)[N+](=O)[O-])CCC(=O)OC)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C(=C1C(C)C)C)C(=C(N2C3=CC=C(C=C3)[N+](=O)[O-])CCC(=O)OC)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H30N2O6S/c1-18(2)27-19(3)17-25-28(20(27)4)29(38(35,36)23-9-7-6-8-10-23)24(15-16-26(32)37-5)30(25)21-11-13-22(14-12-21)31(33)34/h6-14,17-18H,15-16H2,1-5H3