2-ethoxy-3-[4-[2-[6-[(Z)-N-methoxy-C-phenyl-carbonimidoyl]pyrrolo[2,3-b]pyridin-1-yl]ethoxy]phenyl]propanoic acid

Systemtic Name: 2-ethoxy-3-[4-[2-[6-[(Z)-N-methoxy-C-phenyl-carbonimidoyl]pyrrolo[2,3-b]pyridin-1-yl]ethoxy]phenyl]propanoic acid Openeye Name: 2-ethoxy-3-[4-[2-[6-[(Z)-N-methoxy-C-phenyl-carbonimidoyl]pyrrolo[2,3-b]pyridin-1-yl]ethoxy]phenyl]propanoic acid CAS Name: 2-ethoxy-3-[4-[2-[6-[(Z)-methoxyimino(phenyl)methyl]-1-pyrrolo[2,3-b]pyridinyl]ethoxy]phenyl]propanoic acid IUPAC Name: 2-ethoxy-3-[4-[2-[6-[(Z)-N-methoxy-C-phenylcarbonimidoyl]pyrrolo[2,3-b]pyridin-1-yl]ethoxy]phenyl]propanoic acid Traditional Name: 2-ethoxy-3-[4-[2-[6-[(Z)-N-methoxy-C-phenyl-carbonimidoyl]pyrrolo[2,3-b]pyridin-1-yl]ethoxy]phenyl]propionic acid Formula: C28H29N3O5 MolecularWeight: 487.54696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCCN2C=CC3=C2N=C(C=C3)C(=NOC)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)OCCN2C=CC3=C2N=C(C=C3)/C(=N\OC)/C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C28H29N3O5/c1-3-35-25(28(32)33)19-20-9-12-23(13-10-20)36-18-17-31-16-15-22-11-14-24(29-27(22)31)26(30-34-2)21-7-5-4-6-8-21/h4-16,25H,3,17-19H2,1-2H3,(H,32,33)/b30-26-