[(3R)-3-azanyl-4-[(3-octylphenyl)amino]-4-oxidanylidene-butyl]phosphonic acid

Systemtic Name: [(3R)-3-azanyl-4-[(3-octylphenyl)amino]-4-oxidanylidene-butyl]phosphonic acid Openeye Name: [(3R)-3-amino-4-(3-octylanilino)-4-oxo-butyl]phosphonic acid CAS Name: [(3R)-3-amino-4-(3-octylanilino)-4-oxobutyl]phosphonic acid IUPAC Name: [(3R)-3-amino-4-(3-octylanilino)-4-oxobutyl]phosphonic acid Traditional Name: [(3R)-3-amino-4-keto-4-(3-octylanilino)butyl]phosphonic acid Formula: C18H31N2O4P MolecularWeight: 370.423501

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=CC=C1)NC(=O)C(CCP(=O)(O)O)N

Isomeric SMILES

CCCCCCCCC1=CC(=CC=C1)NC(=O)[C@@H](CCP(=O)(O)O)N

InChI

InChI=1S/C18H31N2O4P/c1-2-3-4-5-6-7-9-15-10-8-11-16(14-15)20-18(21)17(19)12-13-25(22,23)24/h8,10-11,14,17H,2-7,9,12-13,19H2,1H3,(H,20,21)(H2,22,23,24)/t17-/m1/s1