[2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl] 4-methyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: [2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl] 4-methyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: [2-oxo-3-(1,3,3-trimethylindolin-2-ylidene)propyl] 4-methyl-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-methyl-3-(1-piperidinylsulfonyl)benzoic acid [2-oxo-3-(1,3,3-trimethyl-2-indolylidene)propyl] ester IUPAC Name: [2-oxo-3-(1,3,3-trimethylindol-2-ylidene)propyl] 4-methyl-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-methyl-3-piperidinosulfonyl-benzoic acid [2-keto-3-(1,3,3-trimethylindolin-2-ylidene)propyl] ester Formula: C27H32N2O5S MolecularWeight: 496.61838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)C=C2C(C3=CC=CC=C3N2C)(C)C)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)C=C2C(C3=CC=CC=C3N2C)(C)C)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C27H32N2O5S/c1-19-12-13-20(16-24(19)35(32,33)29-14-8-5-9-15-29)26(31)34-18-21(30)17-25-27(2,3)22-10-6-7-11-23(22)28(25)4/h6-7,10-13,16-17H,5,8-9,14-15,18H2,1-4H3