5-methyl-2,3,6-triphenyl-1-(phenylmethyl)pyrrolo[2,3-b]pyridin-7-ium-4-amine

Systemtic Name: 5-methyl-2,3,6-triphenyl-1-(phenylmethyl)pyrrolo[2,3-b]pyridin-7-ium-4-amine Openeye Name: 1-benzyl-5-methyl-2,3,6-triphenyl-pyrrolo[2,3-b]pyridin-7-ium-4-amine CAS Name: 5-methyl-2,3,6-triphenyl-1-(phenylmethyl)-4-pyrrolo[2,3-b]pyridin-7-iumamine IUPAC Name: 1-benzyl-5-methyl-2,3,6-triphenylpyrrolo[2,3-b]pyridin-7-ium-4-amine Traditional Name: (1-benzyl-5-methyl-2,3,6-triphenyl-pyrrolo[2,3-b]pyridin-7-ium-4-yl)amine Formula: C33H28N3+ MolecularWeight: 466.59552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([NH+]=C2C(=C1N)C(=C(N2CC3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC1=C([NH+]=C2C(=C1N)C(=C(N2CC3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C33H27N3/c1-23-30(34)29-28(25-16-8-3-9-17-25)32(27-20-12-5-13-21-27)36(22-24-14-6-2-7-15-24)33(29)35-31(23)26-18-10-4-11-19-26/h2-21H,22H2,1H3,(H2,34,35)/p+1