[(2E)-2-[(5-methoxy-1-methyl-indol-3-yl)methylidene]-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl-dipropyl-azanium

Systemtic Name: [(2E)-2-[(5-methoxy-1-methyl-indol-3-yl)methylidene]-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl-dipropyl-azanium Openeye Name: [(2E)-6-hydroxy-2-[(5-methoxy-1-methyl-indol-3-yl)methylene]-3-oxo-benzofuran-7-yl]methyl-dipropyl-ammonium CAS Name: [(2E)-6-hydroxy-2-[(5-methoxy-1-methyl-3-indolyl)methylidene]-3-oxo-7-benzofuranyl]methyl-dipropylammonium IUPAC Name: [(2E)-6-hydroxy-2-[(5-methoxy-1-methylindol-3-yl)methylidene]-3-oxo-1-benzofuran-7-yl]methyl-dipropylazanium Traditional Name: [(2E)-6-hydroxy-3-keto-2-[(5-methoxy-1-methyl-indol-3-yl)methylene]coumaran-7-yl]methyl-dipropyl-ammonium Formula: C26H31N2O4+ MolecularWeight: 435.53534

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)CC1=C(C=CC2=C1OC(=CC3=CN(C4=C3C=C(C=C4)OC)C)C2=O)O

Isomeric SMILES

CCC[NH+](CCC)CC1=C(C=CC2=C1O/C(=C/C3=CN(C4=C3C=C(C=C4)OC)C)/C2=O)O

InChI

InChI=1S/C26H30N2O4/c1-5-11-28(12-6-2)16-21-23(29)10-8-19-25(30)24(32-26(19)21)13-17-15-27(3)22-9-7-18(31-4)14-20(17)22/h7-10,13-15,29H,5-6,11-12,16H2,1-4H3/p+1/b24-13+