2-[methyl-[(1-sulfanylcyclohexyl)methyl]amino]ethyl (2S)-2-(6-methoxynaphthalen-2-yl)propanoate

Systemtic Name: 2-[methyl-[(1-sulfanylcyclohexyl)methyl]amino]ethyl (2S)-2-(6-methoxynaphthalen-2-yl)propanoate Openeye Name: 2-[methyl-[(1-sulfanylcyclohexyl)methyl]amino]ethyl (2S)-2-(6-methoxy-2-naphthyl)propanoate CAS Name: (2S)-2-(6-methoxy-2-naphthalenyl)propanoic acid 2-[(1-mercaptocyclohexyl)methyl-methylamino]ethyl ester IUPAC Name: 2-[methyl-[(1-sulfanylcyclohexyl)methyl]amino]ethyl (2S)-2-(6-methoxynaphthalen-2-yl)propanoate Traditional Name: (2S)-2-(6-methoxy-2-naphthyl)propionic acid 2-[(1-mercaptocyclohexyl)methyl-methyl-amino]ethyl ester Formula: C24H33NO3S MolecularWeight: 415.58872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OCCN(C)CC3(CCCCC3)S

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OCCN(C)CC3(CCCCC3)S

InChI

InChI=1S/C24H33NO3S/c1-18(19-7-8-21-16-22(27-3)10-9-20(21)15-19)23(26)28-14-13-25(2)17-24(29)11-5-4-6-12-24/h7-10,15-16,18,29H,4-6,11-14,17H2,1-3H3/t18-/m0/s1