methyl 6-[3-(1-adamantyl)-4-methoxy-phenyl]-4-(dimethylaminosulfanylcarbonyloxy)-1-methyl-naphthalene-2-carboxylate

Systemtic Name: methyl 6-[3-(1-adamantyl)-4-methoxy-phenyl]-4-(dimethylaminosulfanylcarbonyloxy)-1-methyl-naphthalene-2-carboxylate Openeye Name: methyl 6-[3-(1-adamantyl)-4-methoxy-phenyl]-4-(dimethylaminosulfanylcarbonyloxy)-1-methyl-naphthalene-2-carboxylate CAS Name: 6-[3-(1-adamantyl)-4-methoxyphenyl]-4-[(dimethylaminothio)-oxomethoxy]-1-methyl-2-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 6-[3-(1-adamantyl)-4-methoxyphenyl]-4-(dimethylaminosulfanylcarbonyloxy)-1-methylnaphthalene-2-carboxylate Traditional Name: 6-[3-(1-adamantyl)-4-methoxy-phenyl]-4-(dimethylaminothio)carbonyloxy-1-methyl-naphthalene-2-carboxylic acid methyl ester Formula: C33H37NO5S MolecularWeight: 559.71558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC(=CC2=C(C=C1C(=O)OC)OC(=O)SN(C)C)C3=CC(=C(C=C3)OC)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=C2C=CC(=CC2=C(C=C1C(=O)OC)OC(=O)SN(C)C)C3=CC(=C(C=C3)OC)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C33H37NO5S/c1-19-25-8-6-23(13-27(25)30(15-26(19)31(35)38-5)39-32(36)40-34(2)3)24-7-9-29(37-4)28(14-24)33-16-20-10-21(17-33)12-22(11-20)18-33/h6-9,13-15,20-22H,10-12,16-18H2,1-5H3