7-azanylidene-3-ethoxy-6-[2-(4-methoxy-3-morpholin-4-yl-5-propan-2-yl-phenyl)-2-oxidanylidene-ethyl]-5H-pyrrolo[3,4-b]pyridine-2-carboxylic acid

Systemtic Name: 7-azanylidene-3-ethoxy-6-[2-(4-methoxy-3-morpholin-4-yl-5-propan-2-yl-phenyl)-2-oxidanylidene-ethyl]-5H-pyrrolo[3,4-b]pyridine-2-carboxylic acid Openeye Name: 3-ethoxy-7-imino-6-[2-(3-isopropyl-4-methoxy-5-morpholino-phenyl)-2-oxo-ethyl]-5H-pyrrolo[3,4-b]pyridine-2-carboxylic acid CAS Name: 3-ethoxy-7-imino-6-[2-[4-methoxy-3-(4-morpholinyl)-5-propan-2-ylphenyl]-2-oxoethyl]-5H-pyrrolo[3,4-b]pyridine-2-carboxylic acid IUPAC Name: 3-ethoxy-7-imino-6-[2-(4-methoxy-3-morpholin-4-yl-5-propan-2-ylphenyl)-2-oxoethyl]-5H-pyrrolo[3,4-b]pyridine-2-carboxylic acid Traditional Name: 3-ethoxy-7-imino-6-[2-(3-isopropyl-4-methoxy-5-morpholino-phenyl)-2-keto-ethyl]-5H-pyrrolo[3,4-b]pyridine-2-carboxylic acid Formula: C26H32N4O6 MolecularWeight: 496.55548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(N=C2C(=C1)CN(C2=N)CC(=O)C3=CC(=C(C(=C3)N4CCOCC4)OC)C(C)C)C(=O)O

Isomeric SMILES

CCOC1=C(N=C2C(=C1)CN(C2=N)CC(=O)C3=CC(=C(C(=C3)N4CCOCC4)OC)C(C)C)C(=O)O

InChI

InChI=1S/C26H32N4O6/c1-5-36-21-12-17-13-30(25(27)22(17)28-23(21)26(32)33)14-20(31)16-10-18(15(2)3)24(34-4)19(11-16)29-6-8-35-9-7-29/h10-12,15,27H,5-9,13-14H2,1-4H3,(H,32,33)