[(2S)-2-azanyl-3-[(4-hexylphenyl)amino]-3-oxidanylidene-propyl] dihydrogen phosphate

Systemtic Name: [(2S)-2-azanyl-3-[(4-hexylphenyl)amino]-3-oxidanylidene-propyl] dihydrogen phosphate Openeye Name: [(2S)-2-amino-3-(4-hexylanilino)-3-oxo-propyl] dihydrogen phosphate CAS Name: [(2S)-2-amino-3-(4-hexylanilino)-3-oxopropyl] dihydrogen phosphate IUPAC Name: [(2S)-2-amino-3-(4-hexylanilino)-3-oxopropyl] dihydrogen phosphate Traditional Name: [(2S)-2-amino-3-(4-hexylanilino)-3-keto-propyl] dihydrogen phosphate Formula: C15H25N2O5P MolecularWeight: 344.343161

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)NC(=O)C(COP(=O)(O)O)N

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)NC(=O)[C@H](COP(=O)(O)O)N

InChI

InChI=1S/C15H25N2O5P/c1-2-3-4-5-6-12-7-9-13(10-8-12)17-15(18)14(16)11-22-23(19,20)21/h7-10,14H,2-6,11,16H2,1H3,(H,17,18)(H2,19,20,21)/t14-/m0/s1