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

Systemtic Name: (4-nitrophenyl)methyl N-[1-[3-methyl-3-phenyl-5-(phenylsulfonyl)pentyl]piperidin-4-yl]-N-prop-2-enyl-carbamate Openeye Name: (4-nitrophenyl)methyl N-allyl-N-[1-[5-(benzenesulfonyl)-3-methyl-3-phenyl-pentyl]-4-piperidyl]carbamate CAS Name: N-[1-[5-(benzenesulfonyl)-3-methyl-3-phenylpentyl]-4-piperidinyl]-N-prop-2-enylcarbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-[1-[5-(benzenesulfonyl)-3-methyl-3-phenylpentyl]piperidin-4-yl]-N-prop-2-enylcarbamate Traditional Name: N-allyl-N-[1-(5-besyl-3-methyl-3-phenyl-pentyl)-4-piperidyl]carbamic acid (4-nitrobenzyl) ester Formula: C34H41N3O6S MolecularWeight: 619.77084

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1CCC(CC1)N(CC=C)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])(CCS(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(CCN1CCC(CC1)N(CC=C)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])(CCS(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C34H41N3O6S/c1-3-22-36(33(38)43-27-28-14-16-31(17-15-28)37(39)40)30-18-23-35(24-19-30)25-20-34(2,29-10-6-4-7-11-29)21-26-44(41,42)32-12-8-5-9-13-32/h3-17,30H,1,18-27H2,2H3