2,3,5-trimethyl-1-(3-morpholin-4-ylpropyl)-6-phenyl-pyrrolo[2,3-b]pyridin-7-ium-4-amine

Systemtic Name: 2,3,5-trimethyl-1-(3-morpholin-4-ylpropyl)-6-phenyl-pyrrolo[2,3-b]pyridin-7-ium-4-amine Openeye Name: 2,3,5-trimethyl-1-(3-morpholinopropyl)-6-phenyl-pyrrolo[2,3-b]pyridin-7-ium-4-amine CAS Name: 2,3,5-trimethyl-1-[3-(4-morpholinyl)propyl]-6-phenyl-4-pyrrolo[2,3-b]pyridin-7-iumamine IUPAC Name: 2,3,5-trimethyl-1-(3-morpholin-4-ylpropyl)-6-phenylpyrrolo[2,3-b]pyridin-7-ium-4-amine Traditional Name: [2,3,5-trimethyl-1-(3-morpholinopropyl)-6-phenyl-pyrrolo[2,3-b]pyridin-7-ium-4-yl]amine Formula: C23H31N4O+ MolecularWeight: 379.51844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=[NH+]C(=C(C(=C12)N)C)C3=CC=CC=C3)CCCN4CCOCC4)C

Isomeric SMILES

CC1=C(N(C2=[NH+]C(=C(C(=C12)N)C)C3=CC=CC=C3)CCCN4CCOCC4)C

InChI

InChI=1S/C23H30N4O/c1-16-18(3)27(11-7-10-26-12-14-28-15-13-26)23-20(16)21(24)17(2)22(25-23)19-8-5-4-6-9-19/h4-6,8-9H,7,10-15H2,1-3H3,(H2,24,25)/p+1