(4-piperidin-4-ylphenyl) 2-[(2-butylsulfonylhydrazinyl)methyl]-3-oxidanylidene-pentanoate

Systemtic Name: (4-piperidin-4-ylphenyl) 2-[(2-butylsulfonylhydrazinyl)methyl]-3-oxidanylidene-pentanoate Openeye Name: [4-(4-piperidyl)phenyl] 2-[(2-butylsulfonylhydrazino)methyl]-3-oxo-pentanoate CAS Name: 2-[(butylsulfonylhydrazo)methyl]-3-oxopentanoic acid [4-(4-piperidinyl)phenyl] ester IUPAC Name: (4-piperidin-4-ylphenyl) 2-[(2-butylsulfonylhydrazinyl)methyl]-3-oxopentanoate Traditional Name: 2-[(N'-butylsulfonylhydrazino)methyl]-3-keto-valeric acid [4-(4-piperidyl)phenyl] ester Formula: C21H33N3O5S MolecularWeight: 439.56882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NNCC(C(=O)CC)C(=O)OC1=CC=C(C=C1)C2CCNCC2

Isomeric SMILES

CCCCS(=O)(=O)NNCC(C(=O)CC)C(=O)OC1=CC=C(C=C1)C2CCNCC2

InChI

InChI=1S/C21H33N3O5S/c1-3-5-14-30(27,28)24-23-15-19(20(25)4-2)21(26)29-18-8-6-16(7-9-18)17-10-12-22-13-11-17/h6-9,17,19,22-24H,3-5,10-15H2,1-2H3