2-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoyloxy]ethyl 3-butylsulfanyl-2-methyl-propanoate

Systemtic Name: 2-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoyloxy]ethyl 3-butylsulfanyl-2-methyl-propanoate Openeye Name: 2-[[1-(3-isopropenylphenyl)-1-methyl-ethyl]carbamoyloxy]ethyl 3-butylsulfanyl-2-methyl-propanoate CAS Name: 3-(butylthio)-2-methylpropanoic acid 2-[[2-[3-(1-methylethenyl)phenyl]propan-2-ylamino]-oxomethoxy]ethyl ester IUPAC Name: 2-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoyloxy]ethyl 3-butylsulfanyl-2-methylpropanoate Traditional Name: 3-(butylthio)-2-methyl-propionic acid 2-[[1-(3-isopropenylphenyl)-1-methyl-ethyl]carbamoyloxy]ethyl ester Formula: C23H35NO4S MolecularWeight: 421.5933

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC(C)C(=O)OCCOC(=O)NC(C)(C)C1=CC=CC(=C1)C(=C)C

Isomeric SMILES

CCCCSCC(C)C(=O)OCCOC(=O)NC(C)(C)C1=CC=CC(=C1)C(=C)C

InChI

InChI=1S/C23H35NO4S/c1-7-8-14-29-16-18(4)21(25)27-12-13-28-22(26)24-23(5,6)20-11-9-10-19(15-20)17(2)3/h9-11,15,18H,2,7-8,12-14,16H2,1,3-6H3,(H,24,26)