5,7-dimethoxy-3',3'-dimethyl-6-nitro-1'-octadecyl-spiro[chromene-2,2'-indole]

Systemtic Name: 5,7-dimethoxy-3',3'-dimethyl-6-nitro-1'-octadecyl-spiro[chromene-2,2'-indole] Openeye Name: 5,7-dimethoxy-3',3'-dimethyl-6-nitro-1'-octadecyl-spiro[chromene-2,2'-indoline] CAS Name: 5,7-dimethoxy-3',3'-dimethyl-6-nitro-1'-octadecylspiro[1-benzopyran-2,2'-indole] IUPAC Name: 5,7-dimethoxy-3',3'-dimethyl-6-nitro-1'-octadecylspiro[chromene-2,2'-indole] Traditional Name: 5,7-dimethoxy-3',3'-dimethyl-6-nitro-1'-stearyl-spiro[chromene-2,2'-indoline] Formula: C38H56N2O5 MolecularWeight: 620.86164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN1C2=CC=CC=C2C(C13C=CC4=C(C(=C(C=C4O3)OC)[N+](=O)[O-])OC)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN1C2=CC=CC=C2C(C13C=CC4=C(C(=C(C=C4O3)OC)[N+](=O)[O-])OC)(C)C

InChI

InChI=1S/C38H56N2O5/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-28-39-32-25-22-21-24-31(32)37(2,3)38(39)27-26-30-33(45-38)29-34(43-4)35(40(41)42)36(30)44-5/h21-22,24-27,29H,6-20,23,28H2,1-5H3