1-[[4-(4-methanoylpiperidin-1-yl)sulfonylphenyl]carbamoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[[4-(4-methanoylpiperidin-1-yl)sulfonylphenyl]carbamoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[[4-[(4-formyl-1-piperidyl)sulfonyl]phenyl]carbamoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[4-[(4-formyl-1-piperidinyl)sulfonyl]anilino]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[[4-(4-formylpiperidin-1-yl)sulfonylphenyl]carbamoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[[4-(4-formylpiperidino)sulfonylphenyl]carbamoyl]proline Formula: C18H23N3O6S MolecularWeight: 409.45672

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C=O)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C=O)C(=O)O

InChI

InChI=1S/C18H23N3O6S/c22-12-13-7-10-20(11-8-13)28(26,27)15-5-3-14(4-6-15)19-18(25)21-9-1-2-16(21)17(23)24/h3-6,12-13,16H,1-2,7-11H2,(H,19,25)(H,23,24)