[2-[[4-(2-adamantyl)-5-methyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]phosphonic acid

Systemtic Name: [2-[[4-(2-adamantyl)-5-methyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]phosphonic acid Openeye Name: [2-[[4-(2-adamantyl)-5-methyl-2-thienyl]amino]-2-oxo-ethyl]phosphonic acid CAS Name: [2-[[4-(2-adamantyl)-5-methyl-2-thiophenyl]amino]-2-oxoethyl]phosphonic acid IUPAC Name: [2-[[4-(2-adamantyl)-5-methylthiophen-2-yl]amino]-2-oxoethyl]phosphonic acid Traditional Name: [2-[[4-(2-adamantyl)-5-methyl-2-thienyl]amino]-2-keto-ethyl]phosphonic acid Formula: C17H24NO4PS MolecularWeight: 369.415521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)NC(=O)CP(=O)(O)O)C2C3CC4CC(C3)CC2C4

Isomeric SMILES

CC1=C(C=C(S1)NC(=O)CP(=O)(O)O)C2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C17H24NO4PS/c1-9-14(7-16(24-9)18-15(19)8-23(20,21)22)17-12-3-10-2-11(5-12)6-13(17)4-10/h7,10-13,17H,2-6,8H2,1H3,(H,18,19)(H2,20,21,22)