ethyl 1-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]piperidine-2-carboxylate

Systemtic Name: ethyl 1-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]piperidine-2-carboxylate Openeye Name: ethyl 1-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]piperidine-2-carboxylate CAS Name: 1-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]-2-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]piperidine-2-carboxylate Traditional Name: 1-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]pipecolinic acid ethyl ester Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCN1S(=O)(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CCCCN1S(=O)(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O4S/c1-2-28-21(25)19-10-6-7-13-24(19)29(26,27)16-11-12-17-18(14-16)23-20(22-17)15-8-4-3-5-9-15/h3-5,8-9,11-12,14,19H,2,6-7,10,13H2,1H3,(H,22,23)