(4-nitrophenyl)methyl N-ethyl-N-[1-[(3S)-3-methyl-4-[methyl(phenylsulfonyl)amino]-3-phenyl-butyl]piperidin-4-yl]carbamate

Systemtic Name: (4-nitrophenyl)methyl N-ethyl-N-[1-[(3S)-3-methyl-4-[methyl(phenylsulfonyl)amino]-3-phenyl-butyl]piperidin-4-yl]carbamate Openeye Name: (4-nitrophenyl)methyl N-[1-[(3S)-4-[benzenesulfonyl(methyl)amino]-3-methyl-3-phenyl-butyl]-4-piperidyl]-N-ethyl-carbamate CAS Name: N-[1-[(3S)-4-[benzenesulfonyl(methyl)amino]-3-methyl-3-phenylbutyl]-4-piperidinyl]-N-ethylcarbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-[1-[(3S)-4-[benzenesulfonyl(methyl)amino]-3-methyl-3-phenylbutyl]piperidin-4-yl]-N-ethylcarbamate Traditional Name: N-[1-[(3S)-4-[besyl(methyl)amino]-3-methyl-3-phenyl-butyl]-4-piperidyl]-N-ethyl-carbamic acid (4-nitrobenzyl) ester Formula: C33H42N4O6S MolecularWeight: 622.77478

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCN(CC1)CCC(C)(CN(C)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCN(C1CCN(CC1)CC[C@](C)(CN(C)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C33H42N4O6S/c1-4-36(32(38)43-25-27-15-17-30(18-16-27)37(39)40)29-19-22-35(23-20-29)24-21-33(2,28-11-7-5-8-12-28)26-34(3)44(41,42)31-13-9-6-10-14-31/h5-18,29H,4,19-26H2,1-3H3/t33-/m1/s1