tert-butyl 4-[3-azanyl-1-methoxy-2-(4-methoxyphenyl)sulfonyl-3-oxidanylidene-2-(propylamino)propyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-azanyl-1-methoxy-2-(4-methoxyphenyl)sulfonyl-3-oxidanylidene-2-(propylamino)propyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[3-amino-1-methoxy-2-(4-methoxyphenyl)sulfonyl-3-oxo-2-(propylamino)propyl]piperidine-1-carboxylate CAS Name: 4-[3-amino-1-methoxy-2-(4-methoxyphenyl)sulfonyl-3-oxo-2-(propylamino)propyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-amino-1-methoxy-2-(4-methoxyphenyl)sulfonyl-3-oxo-2-(propylamino)propyl]piperidine-1-carboxylate Traditional Name: 4-[3-amino-3-keto-1-methoxy-2-(4-methoxyphenyl)sulfonyl-2-(propylamino)propyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H39N3O7S MolecularWeight: 513.64736

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(C(C1CCN(CC1)C(=O)OC(C)(C)C)OC)(C(=O)N)S(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCNC(C(C1CCN(CC1)C(=O)OC(C)(C)C)OC)(C(=O)N)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C24H39N3O7S/c1-7-14-26-24(21(25)28,35(30,31)19-10-8-18(32-5)9-11-19)20(33-6)17-12-15-27(16-13-17)22(29)34-23(2,3)4/h8-11,17,20,26H,7,12-16H2,1-6H3,(H2,25,28)