[1-[(9-ethylcarbazol-3-yl)amino]-1-oxidanylidene-propan-2-yl] 2-methylsulfonylbenzoate

Systemtic Name: [1-[(9-ethylcarbazol-3-yl)amino]-1-oxidanylidene-propan-2-yl] 2-methylsulfonylbenzoate Openeye Name: [2-[(9-ethylcarbazol-3-yl)amino]-1-methyl-2-oxo-ethyl] 2-methylsulfonylbenzoate CAS Name: 2-methylsulfonylbenzoic acid [1-[(9-ethyl-3-carbazolyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(9-ethylcarbazol-3-yl)amino]-1-oxopropan-2-yl] 2-methylsulfonylbenzoate Traditional Name: 2-mesylbenzoic acid [2-[(9-ethylcarbazol-3-yl)amino]-2-keto-1-methyl-ethyl] ester Formula: C25H24N2O5S MolecularWeight: 464.53346

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C(C)OC(=O)C3=CC=CC=C3S(=O)(=O)C)C4=CC=CC=C41

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C(C)OC(=O)C3=CC=CC=C3S(=O)(=O)C)C4=CC=CC=C41

InChI

InChI=1S/C25H24N2O5S/c1-4-27-21-11-7-5-9-18(21)20-15-17(13-14-22(20)27)26-24(28)16(2)32-25(29)19-10-6-8-12-23(19)33(3,30)31/h5-16H,4H2,1-3H3,(H,26,28)