6,8-dimethyl-4-[[2-(3-nitrophenoxy)propan-2-ylamino]methyl]-2,3-dihydrochromen-4-ol

Systemtic Name: 6,8-dimethyl-4-[[2-(3-nitrophenoxy)propan-2-ylamino]methyl]-2,3-dihydrochromen-4-ol Openeye Name: 6,8-dimethyl-4-[[[1-methyl-1-(3-nitrophenoxy)ethyl]amino]methyl]chroman-4-ol CAS Name: 6,8-dimethyl-4-[[2-(3-nitrophenoxy)propan-2-ylamino]methyl]-3,4-dihydro-2H-1-benzopyran-4-ol IUPAC Name: 6,8-dimethyl-4-[[2-(3-nitrophenoxy)propan-2-ylamino]methyl]-2,3-dihydrochromen-4-ol Traditional Name: 6,8-dimethyl-4-[[[1-methyl-1-(3-nitrophenoxy)ethyl]amino]methyl]chroman-4-ol Formula: C21H26N2O5 MolecularWeight: 386.44154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(CCO2)(CNC(C)(C)OC3=CC=CC(=C3)[N+](=O)[O-])O)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(CCO2)(CNC(C)(C)OC3=CC=CC(=C3)[N+](=O)[O-])O)C

InChI

InChI=1S/C21H26N2O5/c1-14-10-15(2)19-18(11-14)21(24,8-9-27-19)13-22-20(3,4)28-17-7-5-6-16(12-17)23(25)26/h5-7,10-12,22,24H,8-9,13H2,1-4H3