methyl 2-[(4-methoxyphenyl)methylamino]-2-methyl-3-(3-methylbutylsulfanyl)propanoate

Systemtic Name: methyl 2-[(4-methoxyphenyl)methylamino]-2-methyl-3-(3-methylbutylsulfanyl)propanoate Openeye Name: methyl 3-isopentylsulfanyl-2-[(4-methoxyphenyl)methylamino]-2-methyl-propanoate CAS Name: 2-[(4-methoxyphenyl)methylamino]-2-methyl-3-(3-methylbutylthio)propanoic acid methyl ester IUPAC Name: methyl 2-[(4-methoxyphenyl)methylamino]-2-methyl-3-(3-methylbutylsulfanyl)propanoate Traditional Name: 3-(isoamylthio)-2-methyl-2-(p-anisylamino)propionic acid methyl ester Formula: C18H29NO3S MolecularWeight: 339.49276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSCC(C)(C(=O)OC)NCC1=CC=C(C=C1)OC

Isomeric SMILES

CC(C)CCSCC(C)(C(=O)OC)NCC1=CC=C(C=C1)OC

InChI

InChI=1S/C18H29NO3S/c1-14(2)10-11-23-13-18(3,17(20)22-5)19-12-15-6-8-16(21-4)9-7-15/h6-9,14,19H,10-13H2,1-5H3