tert-butyl N-[(2S,3R)-4-[(2-hex-5-enoxy-4-methoxy-phenyl)sulfonyl-prop-2-enyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3R)-4-[(2-hex-5-enoxy-4-methoxy-phenyl)sulfonyl-prop-2-enyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2R)-3-[allyl-(2-hex-5-enoxy-4-methoxy-phenyl)sulfonyl-amino]-1-benzyl-2-hydroxy-propyl]carbamate CAS Name: N-[(2S,3R)-4-[(2-hex-5-enoxy-4-methoxyphenyl)sulfonyl-prop-2-enylamino]-3-hydroxy-1-phenylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3R)-4-[(2-hex-5-enoxy-4-methoxyphenyl)sulfonyl-prop-2-enylamino]-3-hydroxy-1-phenylbutan-2-yl]carbamate Traditional Name: N-[(1S,2R)-3-[allyl-(2-hex-5-enoxy-4-methoxy-phenyl)sulfonyl-amino]-1-benzyl-2-hydroxy-propyl]carbamic acid tert-butyl ester Formula: C31H44N2O7S MolecularWeight: 588.75526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(CN(CC=C)S(=O)(=O)C2=C(C=C(C=C2)OC)OCCCCC=C)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)[C@@H](CN(CC=C)S(=O)(=O)C2=C(C=C(C=C2)OC)OCCCCC=C)O

InChI

InChI=1S/C31H44N2O7S/c1-7-9-10-14-20-39-28-22-25(38-6)17-18-29(28)41(36,37)33(19-8-2)23-27(34)26(21-24-15-12-11-13-16-24)32-30(35)40-31(3,4)5/h7-8,11-13,15-18,22,26-27,34H,1-2,9-10,14,19-21,23H2,3-6H3,(H,32,35)/t26-,27+/m0/s1