(phenylmethyl) 2-[[1-[3-(hydroxymethyl)-4-[methyl(phenylsulfonyl)amino]-3-phenyl-butyl]piperidin-4-yl]amino]but-3-enoate

Systemtic Name: (phenylmethyl) 2-[[1-[3-(hydroxymethyl)-4-[methyl(phenylsulfonyl)amino]-3-phenyl-butyl]piperidin-4-yl]amino]but-3-enoate Openeye Name: benzyl 2-[[1-[3-[[benzenesulfonyl(methyl)amino]methyl]-4-hydroxy-3-phenyl-butyl]-4-piperidyl]amino]but-3-enoate CAS Name: 2-[[1-[3-[[benzenesulfonyl(methyl)amino]methyl]-4-hydroxy-3-phenylbutyl]-4-piperidinyl]amino]-3-butenoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[1-[3-[[benzenesulfonyl(methyl)amino]methyl]-4-hydroxy-3-phenylbutyl]piperidin-4-yl]amino]but-3-enoate Traditional Name: 2-[[1-[3-[[besyl(methyl)amino]methyl]-4-hydroxy-3-phenyl-butyl]-4-piperidyl]amino]but-3-enoic acid benzyl ester Formula: C34H43N3O5S MolecularWeight: 605.78732

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(CCN1CCC(CC1)NC(C=C)C(=O)OCC2=CC=CC=C2)(CO)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CN(CC(CCN1CCC(CC1)NC(C=C)C(=O)OCC2=CC=CC=C2)(CO)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C34H43N3O5S/c1-3-32(33(39)42-25-28-13-7-4-8-14-28)35-30-19-22-37(23-20-30)24-21-34(27-38,29-15-9-5-10-16-29)26-36(2)43(40,41)31-17-11-6-12-18-31/h3-18,30,32,35,38H,1,19-27H2,2H3