5-azanylpentyl 1-(2-azanyl-3-phenyl-phenyl)sulfonylpiperidine-2-carboxylate

Systemtic Name: 5-azanylpentyl 1-(2-azanyl-3-phenyl-phenyl)sulfonylpiperidine-2-carboxylate Openeye Name: 5-aminopentyl 1-(2-amino-3-phenyl-phenyl)sulfonylpiperidine-2-carboxylate CAS Name: 1-(2-amino-3-phenylphenyl)sulfonyl-2-piperidinecarboxylic acid 5-aminopentyl ester IUPAC Name: 5-aminopentyl 1-(2-amino-3-phenylphenyl)sulfonylpiperidine-2-carboxylate Traditional Name: 1-(2-amino-3-phenyl-phenyl)sulfonylpipecolinic acid 5-aminopentyl ester Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)OCCCCCN)S(=O)(=O)C2=CC=CC(=C2N)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C(C1)C(=O)OCCCCCN)S(=O)(=O)C2=CC=CC(=C2N)C3=CC=CC=C3

InChI

InChI=1S/C23H31N3O4S/c24-15-6-2-8-17-30-23(27)20-13-5-7-16-26(20)31(28,29)21-14-9-12-19(22(21)25)18-10-3-1-4-11-18/h1,3-4,9-12,14,20H,2,5-8,13,15-17,24-25H2