(4-nitrophenyl)methyl N-[1-(5-ethylsulfonyl-3-methyl-3-phenyl-pentyl)piperidin-4-yl]-N-prop-2-enyl-carbamate

Systemtic Name: (4-nitrophenyl)methyl N-[1-(5-ethylsulfonyl-3-methyl-3-phenyl-pentyl)piperidin-4-yl]-N-prop-2-enyl-carbamate Openeye Name: (4-nitrophenyl)methyl N-allyl-N-[1-(5-ethylsulfonyl-3-methyl-3-phenyl-pentyl)-4-piperidyl]carbamate CAS Name: N-[1-(5-ethylsulfonyl-3-methyl-3-phenylpentyl)-4-piperidinyl]-N-prop-2-enylcarbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-[1-(5-ethylsulfonyl-3-methyl-3-phenylpentyl)piperidin-4-yl]-N-prop-2-enylcarbamate Traditional Name: N-allyl-N-[1-(5-esyl-3-methyl-3-phenyl-pentyl)-4-piperidyl]carbamic acid (4-nitrobenzyl) ester Formula: C30H41N3O6S MolecularWeight: 571.72804

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)CCC(C)(CCN1CCC(CC1)N(CC=C)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCS(=O)(=O)CCC(C)(CCN1CCC(CC1)N(CC=C)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C30H41N3O6S/c1-4-19-32(29(34)39-24-25-11-13-28(14-12-25)33(35)36)27-15-20-31(21-16-27)22-17-30(3,18-23-40(37,38)5-2)26-9-7-6-8-10-26/h4,6-14,27H,1,5,15-24H2,2-3H3