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

Systemtic Name: [(2S)-2-azanyl-3-[(3-nonylphenyl)amino]-3-oxidanylidene-propyl] dihydrogen phosphate Openeye Name: [(2S)-2-amino-3-(3-nonylanilino)-3-oxo-propyl] dihydrogen phosphate CAS Name: [(2S)-2-amino-3-(3-nonylanilino)-3-oxopropyl] dihydrogen phosphate IUPAC Name: [(2S)-2-amino-3-(3-nonylanilino)-3-oxopropyl] dihydrogen phosphate Traditional Name: [(2S)-2-amino-3-keto-3-(3-nonylanilino)propyl] dihydrogen phosphate Formula: C18H31N2O5P MolecularWeight: 386.422901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC(=CC=C1)NC(=O)C(COP(=O)(O)O)N

Isomeric SMILES

CCCCCCCCCC1=CC(=CC=C1)NC(=O)[C@H](COP(=O)(O)O)N

InChI

InChI=1S/C18H31N2O5P/c1-2-3-4-5-6-7-8-10-15-11-9-12-16(13-15)20-18(21)17(19)14-25-26(22,23)24/h9,11-13,17H,2-8,10,14,19H2,1H3,(H,20,21)(H2,22,23,24)/t17-/m0/s1