N-[4-[2-(4-methoxyphenyl)ethylamino]-2,2-dimethyl-7-nitro-3-oxidanyl-3,4-dihydrochromen-6-yl]ethanamide

Systemtic Name: N-[4-[2-(4-methoxyphenyl)ethylamino]-2,2-dimethyl-7-nitro-3-oxidanyl-3,4-dihydrochromen-6-yl]ethanamide Openeye Name: N-[3-hydroxy-4-[2-(4-methoxyphenyl)ethylamino]-2,2-dimethyl-7-nitro-chroman-6-yl]acetamide CAS Name: N-[3-hydroxy-4-[2-(4-methoxyphenyl)ethylamino]-2,2-dimethyl-7-nitro-3,4-dihydro-2H-1-benzopyran-6-yl]acetamide IUPAC Name: N-[3-hydroxy-4-[2-(4-methoxyphenyl)ethylamino]-2,2-dimethyl-7-nitro-3,4-dihydrochromen-6-yl]acetamide Traditional Name: N-[3-hydroxy-4-[2-(4-methoxyphenyl)ethylamino]-2,2-dimethyl-7-nitro-chroman-6-yl]acetamide Formula: C22H27N3O6 MolecularWeight: 429.46628

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C2C(=C1)C(C(C(O2)(C)C)O)NCCC3=CC=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=C(C=C2C(=C1)C(C(C(O2)(C)C)O)NCCC3=CC=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O6/c1-13(26)24-17-11-16-19(12-18(17)25(28)29)31-22(2,3)21(27)20(16)23-10-9-14-5-7-15(30-4)8-6-14/h5-8,11-12,20-21,23,27H,9-10H2,1-4H3,(H,24,26)