(4Z)-4-[[5-methoxy-1-(phenylmethyl)indol-3-yl]-oxidanyl-methylidene]oxolane-2,3-dione

Systemtic Name: (4Z)-4-[[5-methoxy-1-(phenylmethyl)indol-3-yl]-oxidanyl-methylidene]oxolane-2,3-dione Openeye Name: (4Z)-4-[(1-benzyl-5-methoxy-indol-3-yl)-hydroxy-methylene]tetrahydrofuran-2,3-dione CAS Name: (4Z)-4-[hydroxy-[5-methoxy-1-(phenylmethyl)-3-indolyl]methylidene]oxolane-2,3-dione IUPAC Name: (4Z)-4-[(1-benzyl-5-methoxyindol-3-yl)-hydroxymethylidene]oxolane-2,3-dione Traditional Name: (4Z)-4-[(1-benzyl-5-methoxy-indol-3-yl)-hydroxy-methylene]tetrahydrofuran-2,3-quinone Formula: C21H17NO5 MolecularWeight: 363.36338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C=C2C(=C3COC(=O)C3=O)O)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N(C=C2/C(=C/3\COC(=O)C3=O)/O)CC4=CC=CC=C4

InChI

InChI=1S/C21H17NO5/c1-26-14-7-8-18-15(9-14)16(19(23)17-12-27-21(25)20(17)24)11-22(18)10-13-5-3-2-4-6-13/h2-9,11,23H,10,12H2,1H3/b19-17-