5'-isothiocyanato-1',3',3'-trimethyl-6-nitro-spiro[chromene-2,2'-indole]

Systemtic Name: 5'-isothiocyanato-1',3',3'-trimethyl-6-nitro-spiro[chromene-2,2'-indole] Openeye Name: 5'-isothiocyanato-1',3',3'-trimethyl-6-nitro-spiro[chromene-2,2'-indoline] CAS Name: 5'-isothiocyanato-1',3',3'-trimethyl-6-nitrospiro[1-benzopyran-2,2'-indole] IUPAC Name: 5'-isothiocyanato-1',3',3'-trimethyl-6-nitrospiro[chromene-2,2'-indole] Traditional Name: 5'-isothiocyanato-1',3',3'-trimethyl-6-nitro-spiro[chromene-2,2'-indoline] Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N3O3S/c1-19(2)16-11-14(21-12-27)4-6-17(16)22(3)20(19)9-8-13-10-15(23(24)25)5-7-18(13)26-20/h4-11H,1-3H3