[2-[(9-ethylcarbazol-3-yl)amino]-2-oxidanylidene-ethyl] 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: [2-[(9-ethylcarbazol-3-yl)amino]-2-oxidanylidene-ethyl] 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: [2-[(9-ethylcarbazol-3-yl)amino]-2-oxo-ethyl] 2-chloro-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-chloro-5-(1-piperidinylsulfonyl)benzoic acid [2-[(9-ethyl-3-carbazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(9-ethylcarbazol-3-yl)amino]-2-oxoethyl] 2-chloro-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-chloro-5-piperidinosulfonyl-benzoic acid [2-[(9-ethylcarbazol-3-yl)amino]-2-keto-ethyl] ester Formula: C28H28ClN3O5S MolecularWeight: 554.05702

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)Cl)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)Cl)C5=CC=CC=C51

InChI

InChI=1S/C28H28ClN3O5S/c1-2-32-25-9-5-4-8-21(25)22-16-19(10-13-26(22)32)30-27(33)18-37-28(34)23-17-20(11-12-24(23)29)38(35,36)31-14-6-3-7-15-31/h4-5,8-13,16-17H,2-3,6-7,14-15,18H2,1H3,(H,30,33)