[(3E)-2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl] 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: [(3E)-2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl] 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: [(3E)-2-oxo-3-(1,3,3-trimethylindolin-2-ylidene)propyl] 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 4-methoxy-3-(1-pyrrolidinylsulfonyl)benzoic acid [(3E)-2-oxo-3-(1,3,3-trimethyl-2-indolylidene)propyl] ester IUPAC Name: [(3E)-2-oxo-3-(1,3,3-trimethylindol-2-ylidene)propyl] 4-methoxy-3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-methoxy-3-pyrrolidinosulfonyl-benzoic acid [(3E)-2-keto-3-(1,3,3-trimethylindolin-2-ylidene)propyl] ester Formula: C26H30N2O6S MolecularWeight: 498.5912

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=CC(=O)COC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCC4)C)C

Isomeric SMILES

CC\1(C2=CC=CC=C2N(/C1=C/C(=O)COC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCC4)C)C

InChI

InChI=1S/C26H30N2O6S/c1-26(2)20-9-5-6-10-21(20)27(3)24(26)16-19(29)17-34-25(30)18-11-12-22(33-4)23(15-18)35(31,32)28-13-7-8-14-28/h5-6,9-12,15-16H,7-8,13-14,17H2,1-4H3/b24-16+