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

Systemtic Name: 2,3,5-trimethyl-1-(2-morpholin-4-ium-4-ylethyl)-6-phenyl-pyrrolo[2,3-b]pyridin-7-ium-4-amine Openeye Name: 2,3,5-trimethyl-1-(2-morpholin-4-ium-4-ylethyl)-6-phenyl-pyrrolo[2,3-b]pyridin-7-ium-4-amine CAS Name: 2,3,5-trimethyl-1-[2-(4-morpholin-4-iumyl)ethyl]-6-phenyl-4-pyrrolo[2,3-b]pyridin-7-iumamine IUPAC Name: 2,3,5-trimethyl-1-(2-morpholin-4-ium-4-ylethyl)-6-phenylpyrrolo[2,3-b]pyridin-7-ium-4-amine Traditional Name: [2,3,5-trimethyl-1-(2-morpholin-4-ium-4-ylethyl)-6-phenyl-pyrrolo[2,3-b]pyridin-7-ium-4-yl]amine Formula: C22H30N4O+2 MolecularWeight: 366.4998

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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)CC[NH+]4CCOCC4)C

Isomeric SMILES

CC1=C(N(C2=[NH+]C(=C(C(=C12)N)C)C3=CC=CC=C3)CC[NH+]4CCOCC4)C

InChI

InChI=1S/C22H28N4O/c1-15-17(3)26(10-9-25-11-13-27-14-12-25)22-19(15)20(23)16(2)21(24-22)18-7-5-4-6-8-18/h4-8H,9-14H2,1-3H3,(H2,23,24)/p+2