prop-2-enyl 2-[4-[dimethylamino-[(5-nitrothiophen-2-yl)methoxy]phosphoryl]oxyphenyl]ethanoate

Systemtic Name: prop-2-enyl 2-[4-[dimethylamino-[(5-nitrothiophen-2-yl)methoxy]phosphoryl]oxyphenyl]ethanoate Openeye Name: allyl 2-[4-[dimethylamino-[(5-nitro-2-thienyl)methoxy]phosphoryl]oxyphenyl]acetate CAS Name: 2-[4-[dimethylamino-[(5-nitro-2-thiophenyl)methoxy]phosphoryl]oxyphenyl]acetic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[4-[dimethylamino-[(5-nitrothiophen-2-yl)methoxy]phosphoryl]oxyphenyl]acetate Traditional Name: 2-[4-[dimethylamino-[(5-nitro-2-thienyl)methoxy]phosphoryl]oxyphenyl]acetic acid allyl ester Formula: C18H21N2O7PS MolecularWeight: 440.407301

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)P(=O)(OCC1=CC=C(S1)[N+](=O)[O-])OC2=CC=C(C=C2)CC(=O)OCC=C

Isomeric SMILES

CN(C)P(=O)(OCC1=CC=C(S1)[N+](=O)[O-])OC2=CC=C(C=C2)CC(=O)OCC=C

InChI

InChI=1S/C18H21N2O7PS/c1-4-11-25-18(21)12-14-5-7-15(8-6-14)27-28(24,19(2)3)26-13-16-9-10-17(29-16)20(22)23/h4-10H,1,11-13H2,2-3H3