3-(3',3'-dimethyl-6-nitro-spiro[7,8-dihydrochromene-2,2'-indole]-1'-yl)propanoate

Systemtic Name: 3-(3',3'-dimethyl-6-nitro-spiro[7,8-dihydrochromene-2,2'-indole]-1'-yl)propanoate Openeye Name: 3-(3',3'-dimethyl-6-nitro-spiro[7,8-dihydrochromene-2,2'-indoline]-1'-yl)propanoate CAS Name: 3-(3',3'-dimethyl-6-nitro-1'-spiro[7,8-dihydro-1-benzopyran-2,2'-indole]yl)propanoate IUPAC Name: 3-(3',3'-dimethyl-6-nitrospiro[7,8-dihydrochromene-2,2'-indole]-1'-yl)propanoate Traditional Name: 3-(3',3'-dimethyl-6-nitro-spiro[7,8-dihydrochromene-2,2'-indoline]-1'-yl)propionate Formula: C21H21N2O5- MolecularWeight: 381.40184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C13C=CC4=C(O3)CCC(=C4)[N+](=O)[O-])CCC(=O)[O-])C

Isomeric SMILES

CC1(C2=CC=CC=C2N(C13C=CC4=C(O3)CCC(=C4)[N+](=O)[O-])CCC(=O)[O-])C

InChI

InChI=1S/C21H22N2O5/c1-20(2)16-5-3-4-6-17(16)22(12-10-19(24)25)21(20)11-9-14-13-15(23(26)27)7-8-18(14)28-21/h3-6,9,11,13H,7-8,10,12H2,1-2H3,(H,24,25)/p-1