4-[(2S)-butan-2-yl]-N-[(S)-phosphonato(thiophen-3-yl)methyl]aniline

Systemtic Name: 4-[(2S)-butan-2-yl]-N-[(S)-phosphonato(thiophen-3-yl)methyl]aniline Openeye Name: 4-[(1S)-1-methylpropyl]-N-[(S)-phosphonato(3-thienyl)methyl]aniline CAS Name: 4-[(2S)-butan-2-yl]-N-[(S)-phosphonato(3-thiophenyl)methyl]aniline IUPAC Name: 4-[(2S)-butan-2-yl]-N-[(S)-phosphonato(thiophen-3-yl)methyl]aniline Traditional Name: [4-[(1S)-1-methylpropyl]phenyl]-[(S)-phosphonato(3-thienyl)methyl]amine Formula: C15H18NO3PS-2 MolecularWeight: 323.347081

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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

CC[C@H](C)C1=CC=C(C=C1)N[C@H](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)/p-2/t11-,15-/m0/s1