methyl 2-[[2-cyanoethoxy(oxidanyl)phosphinothioyl]amino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl 2-[[2-cyanoethoxy(oxidanyl)phosphinothioyl]amino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl 2-[[2-cyanoethoxy(hydroxy)phosphinothioyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[2-cyanoethoxy(hydroxy)phosphinothioyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 2-[[2-cyanoethoxy(hydroxy)phosphinothioyl]amino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[[2-cyanoethoxy(hydroxy)thiophosphoryl]amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C15H18N3O4PS MolecularWeight: 367.359881

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NP(=S)(O)OCCC#N

Isomeric SMILES

COC(=O)C(CC1=CNC2=CC=CC=C21)NP(=S)(O)OCCC#N

InChI

InChI=1S/C15H18N3O4PS/c1-21-15(19)14(18-23(20,24)22-8-4-7-16)9-11-10-17-13-6-3-2-5-12(11)13/h2-3,5-6,10,14,17H,4,8-9H2,1H3,(H2,18,20,24)