[4-(1-adamantylcarbonylamino)-3-methoxy-phenyl] thiocyanate

Systemtic Name: [4-(1-adamantylcarbonylamino)-3-methoxy-phenyl] thiocyanate Openeye Name: [4-(adamantane-1-carbonylamino)-3-methoxy-phenyl] thiocyanate CAS Name: thiocyanic acid [4-[[1-adamantyl(oxo)methyl]amino]-3-methoxyphenyl] ester IUPAC Name: [4-(adamantane-1-carbonylamino)-3-methoxyphenyl] thiocyanate Traditional Name: thiocyanic acid [4-(adamantane-1-carbonylamino)-3-methoxy-phenyl] ester Formula: C19H22N2O2S MolecularWeight: 342.45518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC#N)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=C(C=CC(=C1)SC#N)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H22N2O2S/c1-23-17-7-15(24-11-20)2-3-16(17)21-18(22)19-8-12-4-13(9-19)6-14(5-12)10-19/h2-3,7,12-14H,4-6,8-10H2,1H3,(H,21,22)