2-[6-ethoxy-5-methoxy-2-[(4-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl)carbonyl]-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[6-ethoxy-5-methoxy-2-[(4-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl)carbonyl]-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[6-ethoxy-5-methoxy-2-(4-methyl-3-oxo-1,4-benzoxazine-6-carbonyl)-1H-indol-3-yl]acetic acid CAS Name: 2-[6-ethoxy-5-methoxy-2-[(4-methyl-3-oxo-1,4-benzoxazin-6-yl)-oxomethyl]-1H-indol-3-yl]acetic acid IUPAC Name: 2-[6-ethoxy-5-methoxy-2-(4-methyl-3-oxo-1,4-benzoxazine-6-carbonyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[6-ethoxy-2-(3-keto-4-methyl-1,4-benzoxazine-6-carbonyl)-5-methoxy-1H-indol-3-yl]acetic acid Formula: C23H22N2O7 MolecularWeight: 438.42998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)NC(=C2CC(=O)O)C(=O)C3=CC4=C(C=C3)OCC(=O)N4C)OC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)NC(=C2CC(=O)O)C(=O)C3=CC4=C(C=C3)OCC(=O)N4C)OC

InChI

InChI=1S/C23H22N2O7/c1-4-31-19-10-15-13(8-18(19)30-3)14(9-21(27)28)22(24-15)23(29)12-5-6-17-16(7-12)25(2)20(26)11-32-17/h5-8,10,24H,4,9,11H2,1-3H3,(H,27,28)