N-methyl-N-[(Z)-2-methyl-1-phosphonato-but-1-enyl]aniline

Systemtic Name: N-methyl-N-[(Z)-2-methyl-1-phosphonato-but-1-enyl]aniline Openeye Name: N-methyl-N-[(Z)-2-methyl-1-phosphonato-but-1-enyl]aniline CAS Name: N-methyl-N-[(Z)-2-methyl-1-phosphonatobut-1-enyl]aniline IUPAC Name: N-methyl-N-[(Z)-2-methyl-1-phosphonatobut-1-enyl]aniline Traditional Name: methyl-[(Z)-2-methyl-1-phosphonato-but-1-enyl]-phenyl-amine Formula: C12H16NO3P-2 MolecularWeight: 253.234101

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(N(C)C1=CC=CC=C1)P(=O)([O-])[O-])C

Isomeric SMILES

CC/C(=C(/N(C)C1=CC=CC=C1)\P(=O)([O-])[O-])/C

InChI

InChI=1S/C12H18NO3P/c1-4-10(2)12(17(14,15)16)13(3)11-8-6-5-7-9-11/h5-9H,4H2,1-3H3,(H2,14,15,16)/p-2/b12-10-