methanethiol; 2-[[octadecoxy(oxidanyl)phosphoryl]amino]ethanoic acid

Systemtic Name: methanethiol; 2-[[octadecoxy(oxidanyl)phosphoryl]amino]ethanoic acid Openeye Name: 2-[[hydroxy(octadecoxy)phosphoryl]amino]acetic acid; methanethiol CAS Name: 2-[[hydroxy(octadecoxy)phosphoryl]amino]acetic acid; methanethiol IUPAC Name: 2-[[hydroxy(octadecoxy)phosphoryl]amino]acetic acid; methanethiol Traditional Name: 2-[[hydroxy(stearyloxy)phosphoryl]amino]acetic acid; methanethiol Formula: C21H46NO5PS MolecularWeight: 455.632401

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOP(=O)(NCC(=O)O)O.CS

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOP(=O)(NCC(=O)O)O.CS

InChI

InChI=1S/C20H42NO5P.CH4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26-27(24,25)21-19-20(22)23;1-2/h2-19H2,1H3,(H,22,23)(H2,21,24,25);2H,1H3