methyl 1-[2-oxidanylidene-2-[(4-piperidin-1-ylsulfonylphenyl)methylamino]ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-oxidanylidene-2-[(4-piperidin-1-ylsulfonylphenyl)methylamino]ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-oxo-2-[[4-(1-piperidylsulfonyl)phenyl]methylamino]ethyl]indole-3-carboxylate CAS Name: 1-[2-oxo-2-[[4-(1-piperidinylsulfonyl)phenyl]methylamino]ethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-oxo-2-[(4-piperidin-1-ylsulfonylphenyl)methylamino]ethyl]indole-3-carboxylate Traditional Name: 1-[2-keto-2-[(4-piperidinosulfonylbenzyl)amino]ethyl]indole-3-carboxylic acid methyl ester Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)NCC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)NCC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C24H27N3O5S/c1-32-24(29)21-16-26(22-8-4-3-7-20(21)22)17-23(28)25-15-18-9-11-19(12-10-18)33(30,31)27-13-5-2-6-14-27/h3-4,7-12,16H,2,5-6,13-15,17H2,1H3,(H,25,28)