(2Z)-7-[(dipropylazaniumyl)methyl]-2-[(1-ethylindol-3-yl)methylidene]-3-oxidanylidene-1-benzofuran-6-olate

Systemtic Name: (2Z)-7-[(dipropylazaniumyl)methyl]-2-[(1-ethylindol-3-yl)methylidene]-3-oxidanylidene-1-benzofuran-6-olate Openeye Name: (2Z)-7-[(dipropylammonio)methyl]-2-[(1-ethylindol-3-yl)methylene]-3-oxo-benzofuran-6-olate CAS Name: (2Z)-7-[(dipropylammonio)methyl]-2-[(1-ethyl-3-indolyl)methylidene]-3-oxo-6-benzofuranolate IUPAC Name: (2Z)-7-[(dipropylazaniumyl)methyl]-2-[(1-ethylindol-3-yl)methylidene]-3-oxo-1-benzofuran-6-olate Traditional Name: (2Z)-7-[(dipropylammonio)methyl]-2-[(1-ethylindol-3-yl)methylene]-3-keto-coumaran-6-olate Formula: C26H30N2O3 MolecularWeight: 418.528

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)CC1=C(C=CC2=C1OC(=CC3=CN(C4=CC=CC=C43)CC)C2=O)[O-]

Isomeric SMILES

CCC[NH+](CCC)CC1=C(C=CC2=C1O/C(=C\C3=CN(C4=CC=CC=C43)CC)/C2=O)[O-]

InChI

InChI=1S/C26H30N2O3/c1-4-13-27(14-5-2)17-21-23(29)12-11-20-25(30)24(31-26(20)21)15-18-16-28(6-3)22-10-8-7-9-19(18)22/h7-12,15-16,29H,4-6,13-14,17H2,1-3H3/b24-15-