2-(7-azanylidene-3-ethoxy-2,4-dimethyl-5H-pyrrolo[3,4-b]pyridin-6-yl)-1-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethanone

Systemtic Name: 2-(7-azanylidene-3-ethoxy-2,4-dimethyl-5H-pyrrolo[3,4-b]pyridin-6-yl)-1-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethanone Openeye Name: 1-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-(3-ethoxy-7-imino-2,4-dimethyl-5H-pyrrolo[3,4-b]pyridin-6-yl)ethanone CAS Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(3-ethoxy-7-imino-2,4-dimethyl-5H-pyrrolo[3,4-b]pyridin-6-yl)ethanone IUPAC Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(3-ethoxy-7-imino-2,4-dimethyl-5H-pyrrolo[3,4-b]pyridin-6-yl)ethanone Traditional Name: 1-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-(3-ethoxy-7-imino-2,4-dimethyl-5H-pyrrolo[3,4-b]pyridin-6-yl)ethanone Formula: C27H37N3O3 MolecularWeight: 451.60098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(N=C2C(=C1C)CN(C2=N)CC(=O)C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)C

Isomeric SMILES

CCOC1=C(N=C2C(=C1C)CN(C2=N)CC(=O)C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)C

InChI

InChI=1S/C27H37N3O3/c1-10-33-24-15(2)18-13-30(25(28)22(18)29-16(24)3)14-21(31)17-11-19(26(4,5)6)23(32)20(12-17)27(7,8)9/h11-12,28,32H,10,13-14H2,1-9H3