[[(4-butan-2-ylphenyl)amino]-thiophen-3-yl-methyl]phosphonic acid

Systemtic Name: [[(4-butan-2-ylphenyl)amino]-thiophen-3-yl-methyl]phosphonic acid Openeye Name: [(4-sec-butylanilino)-(3-thienyl)methyl]phosphonic acid CAS Name: [(4-butan-2-ylanilino)-(3-thiophenyl)methyl]phosphonic acid IUPAC Name: [(4-butan-2-ylanilino)-thiophen-3-ylmethyl]phosphonic acid Traditional Name: [(4-sec-butylanilino)-(3-thienyl)methyl]phosphonic acid Formula: C15H20NO3PS MolecularWeight: 325.362961

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(C2=CSC=C2)P(=O)(O)O

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(C2=CSC=C2)P(=O)(O)O

InChI

InChI=1S/C15H20NO3PS/c1-3-11(2)12-4-6-14(7-5-12)16-15(20(17,18)19)13-8-9-21-10-13/h4-11,15-16H,3H2,1-2H3,(H2,17,18,19)