(3R)-N-(4-aminocarbonylphenyl)-1-(3-chloranyl-4-methoxy-phenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3R)-N-(4-aminocarbonylphenyl)-1-(3-chloranyl-4-methoxy-phenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3R)-N-(4-carbamoylphenyl)-1-(3-chloro-4-methoxy-phenyl)sulfonyl-piperidine-3-carboxamide CAS Name: (3R)-N-(4-carbamoylphenyl)-1-(3-chloro-4-methoxyphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3R)-N-(4-carbamoylphenyl)-1-(3-chloro-4-methoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3R)-N-(4-carbamoylphenyl)-1-(3-chloro-4-methoxy-phenyl)sulfonyl-nipecotamide Formula: C20H22ClN3O5S MolecularWeight: 451.92378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=C(C=C3)C(=O)N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C(=O)NC3=CC=C(C=C3)C(=O)N)Cl

InChI

InChI=1S/C20H22ClN3O5S/c1-29-18-9-8-16(11-17(18)21)30(27,28)24-10-2-3-14(12-24)20(26)23-15-6-4-13(5-7-15)19(22)25/h4-9,11,14H,2-3,10,12H2,1H3,(H2,22,25)(H,23,26)/t14-/m1/s1