4-(3',3'-dimethyl-6-nitro-spiro[chromene-2,2'-indole]-1'-yl)butan-2-one

Systemtic Name: 4-(3',3'-dimethyl-6-nitro-spiro[chromene-2,2'-indole]-1'-yl)butan-2-one Openeye Name: 4-(3',3'-dimethyl-6-nitro-spiro[chromene-2,2'-indoline]-1'-yl)butan-2-one CAS Name: 4-(3',3'-dimethyl-6-nitro-1'-spiro[1-benzopyran-2,2'-indole]yl)-2-butanone IUPAC Name: 4-(3',3'-dimethyl-6-nitrospiro[chromene-2,2'-indole]-1'-yl)butan-2-one Traditional Name: 4-(3',3'-dimethyl-6-nitro-spiro[chromene-2,2'-indoline]-1'-yl)butan-2-one Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCN1C2=CC=CC=C2C(C13C=CC4=C(O3)C=CC(=C4)[N+](=O)[O-])(C)C

Isomeric SMILES

CC(=O)CCN1C2=CC=CC=C2C(C13C=CC4=C(O3)C=CC(=C4)[N+](=O)[O-])(C)C

InChI

InChI=1S/C22H22N2O4/c1-15(25)11-13-23-19-7-5-4-6-18(19)21(2,3)22(23)12-10-16-14-17(24(26)27)8-9-20(16)28-22/h4-10,12,14H,11,13H2,1-3H3