[4-(2-dimethylaminoethyloxy)-2-methyl-5-propan-2-yl-phenyl] 2-[2-[(2-methyl-2-nitrososulfanyl-propyl)amino]-2-oxidanylidene-ethoxy]ethanoate

Systemtic Name: [4-(2-dimethylaminoethyloxy)-2-methyl-5-propan-2-yl-phenyl] 2-[2-[(2-methyl-2-nitrososulfanyl-propyl)amino]-2-oxidanylidene-ethoxy]ethanoate Openeye Name: [4-(2-dimethylaminoethyloxy)-5-isopropyl-2-methyl-phenyl] 2-[2-[(2-methyl-2-nitrososulfanyl-propyl)amino]-2-oxo-ethoxy]acetate CAS Name: 2-[2-[[2-methyl-2-(nitrosothio)propyl]amino]-2-oxoethoxy]acetic acid [4-(2-dimethylaminoethyloxy)-2-methyl-5-propan-2-ylphenyl] ester IUPAC Name: [4-(2-dimethylaminoethyloxy)-2-methyl-5-propan-2-ylphenyl] 2-[2-[(2-methyl-2-nitrososulfanylpropyl)amino]-2-oxoethoxy]acetate Traditional Name: 2-[2-keto-2-[[2-methyl-2-(nitrosothio)propyl]amino]ethoxy]acetic acid [4-(2-dimethylaminoethyloxy)-5-isopropyl-2-methyl-phenyl] ester Formula: C22H35N3O6S MolecularWeight: 469.5948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1OC(=O)COCC(=O)NCC(C)(C)SN=O)C(C)C)OCCN(C)C

Isomeric SMILES

CC1=CC(=C(C=C1OC(=O)COCC(=O)NCC(C)(C)SN=O)C(C)C)OCCN(C)C

InChI

InChI=1S/C22H35N3O6S/c1-15(2)17-11-18(16(3)10-19(17)30-9-8-25(6)7)31-21(27)13-29-12-20(26)23-14-22(4,5)32-24-28/h10-11,15H,8-9,12-14H2,1-7H3,(H,23,26)