3-[2-(3-azanylpropyl)-1H-indol-3-yl]-3-(1H-indol-3-yl)-5-(phenylmethyl)-1H-imidazol-3-ium-2-one

Systemtic Name: 3-[2-(3-azanylpropyl)-1H-indol-3-yl]-3-(1H-indol-3-yl)-5-(phenylmethyl)-1H-imidazol-3-ium-2-one Openeye Name: 3-[2-(3-aminopropyl)-1H-indol-3-yl]-5-benzyl-3-(1H-indol-3-yl)-1H-imidazol-3-ium-2-one CAS Name: 3-[2-(3-aminopropyl)-1H-indol-3-yl]-3-(1H-indol-3-yl)-5-(phenylmethyl)-1H-imidazol-3-ium-2-one IUPAC Name: 3-[2-(3-aminopropyl)-1H-indol-3-yl]-5-benzyl-3-(1H-indol-3-yl)-1H-imidazol-3-ium-2-one Traditional Name: 1-[2-(3-aminopropyl)-1H-indol-3-yl]-4-benzyl-1-(1H-indol-3-yl)-4-imidazolin-1-ium-2-one Formula: C29H28N5O+ MolecularWeight: 462.56552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C[N+](C(=O)N2)(C3=CNC4=CC=CC=C43)C5=C(NC6=CC=CC=C65)CCCN

Isomeric SMILES

C1=CC=C(C=C1)CC2=C[N+](C(=O)N2)(C3=CNC4=CC=CC=C43)C5=C(NC6=CC=CC=C65)CCCN

InChI

InChI=1S/C29H27N5O/c30-16-8-15-26-28(23-12-5-7-14-25(23)33-26)34(27-18-31-24-13-6-4-11-22(24)27)19-21(32-29(34)35)17-20-9-2-1-3-10-20/h1-7,9-14,18-19,31,33H,8,15-17,30H2/p+1