8-bromanyl-1'-butyl-3',3'-dimethyl-6-nitro-spiro[chromene-2,2'-indole]

Systemtic Name: 8-bromanyl-1'-butyl-3',3'-dimethyl-6-nitro-spiro[chromene-2,2'-indole] Openeye Name: 8-bromo-1'-butyl-3',3'-dimethyl-6-nitro-spiro[chromene-2,2'-indoline] CAS Name: 8-bromo-1'-butyl-3',3'-dimethyl-6-nitrospiro[1-benzopyran-2,2'-indole] IUPAC Name: 8-bromo-1'-butyl-3',3'-dimethyl-6-nitrospiro[chromene-2,2'-indole] Traditional Name: 8-bromo-1'-butyl-3',3'-dimethyl-6-nitro-spiro[chromene-2,2'-indoline] Formula: C22H23BrN2O3 MolecularWeight: 443.33362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2C(C13C=CC4=CC(=CC(=C4O3)Br)[N+](=O)[O-])(C)C

Isomeric SMILES

CCCCN1C2=CC=CC=C2C(C13C=CC4=CC(=CC(=C4O3)Br)[N+](=O)[O-])(C)C

InChI

InChI=1S/C22H23BrN2O3/c1-4-5-12-24-19-9-7-6-8-17(19)21(2,3)22(24)11-10-15-13-16(25(26)27)14-18(23)20(15)28-22/h6-11,13-14H,4-5,12H2,1-3H3