sodium 5-(1,3-dimethylindol-2-yl)-2-[1-(ethoxyamino)butylidene]cyclohexane-1,3-dione

Systemtic Name: sodium 5-(1,3-dimethylindol-2-yl)-2-[1-(ethoxyamino)butylidene]cyclohexane-1,3-dione Openeye Name: sodium 5-(1,3-dimethylindol-2-yl)-2-[1-(ethoxyamino)butylidene]cyclohexane-1,3-dione CAS Name: sodium 5-(1,3-dimethyl-2-indolyl)-2-[1-(ethoxyamino)butylidene]cyclohexane-1,3-dione IUPAC Name: sodium 5-(1,3-dimethylindol-2-yl)-2-[1-(ethoxyamino)butylidene]cyclohexane-1,3-dione Traditional Name: sodium 5-(1,3-dimethylindol-2-yl)-2-[1-(ethoxyamino)butylidene]cyclohexane-1,3-quinone Formula: C22H28N2NaO3+ MolecularWeight: 391.45909

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C1C(=O)CC(CC1=O)C2=C(C3=CC=CC=C3N2C)C)NOCC.[Na+]

Isomeric SMILES

CCCC(=C1C(=O)CC(CC1=O)C2=C(C3=CC=CC=C3N2C)C)NOCC.[Na+]

InChI

InChI=1S/C22H28N2O3.Na/c1-5-9-17(23-27-6-2)21-19(25)12-15(13-20(21)26)22-14(3)16-10-7-8-11-18(16)24(22)4;/h7-8,10-11,15,23H,5-6,9,12-13H2,1-4H3;/q;+1