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

Systemtic Name: N-[(3R,4S)-4-ethoxy-2,2-dimethyl-7-nitro-3-oxidanyl-3,4-dihydrochromen-6-yl]-2-(4-methoxyphenyl)ethanamide Openeye Name: N-[(3R,4S)-4-ethoxy-3-hydroxy-2,2-dimethyl-7-nitro-chroman-6-yl]-2-(4-methoxyphenyl)acetamide CAS Name: N-[(3R,4S)-4-ethoxy-3-hydroxy-2,2-dimethyl-7-nitro-3,4-dihydro-2H-1-benzopyran-6-yl]-2-(4-methoxyphenyl)acetamide IUPAC Name: N-[(3R,4S)-4-ethoxy-3-hydroxy-2,2-dimethyl-7-nitro-3,4-dihydrochromen-6-yl]-2-(4-methoxyphenyl)acetamide Traditional Name: N-[(3R,4S)-4-ethoxy-3-hydroxy-2,2-dimethyl-7-nitro-chroman-6-yl]-2-(4-methoxyphenyl)acetamide Formula: C22H26N2O7 MolecularWeight: 430.45104

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1C(C(OC2=CC(=C(C=C12)NC(=O)CC3=CC=C(C=C3)OC)[N+](=O)[O-])(C)C)O

Isomeric SMILES

CCO[C@@H]1[C@H](C(OC2=CC(=C(C=C12)NC(=O)CC3=CC=C(C=C3)OC)[N+](=O)[O-])(C)C)O

InChI

InChI=1S/C22H26N2O7/c1-5-30-20-15-11-16(23-19(25)10-13-6-8-14(29-4)9-7-13)17(24(27)28)12-18(15)31-22(2,3)21(20)26/h6-9,11-12,20-21,26H,5,10H2,1-4H3,(H,23,25)/t20-,21+/m0/s1