ethyl 4-[(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)carbamoyl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)carbamoyl]piperidine-1-carboxylate Openeye Name: ethyl 4-[(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[4-chloro-3-(1-pyrrolidinylsulfonyl)anilino]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(4-chloro-3-pyrrolidinosulfonyl-phenyl)carbamoyl]piperidine-1-carboxylic acid ethyl ester Formula: C19H26ClN3O5S MolecularWeight: 443.94484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)C(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)C(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H26ClN3O5S/c1-2-28-19(25)22-11-7-14(8-12-22)18(24)21-15-5-6-16(20)17(13-15)29(26,27)23-9-3-4-10-23/h5-6,13-14H,2-4,7-12H2,1H3,(H,21,24)