9-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2,3-dihydro-1H-cyclopenta[b]quinoline-7-carboxylic acid

Systemtic Name: 9-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2,3-dihydro-1H-cyclopenta[b]quinoline-7-carboxylic acid Openeye Name: 9-(4-benzhydrylpiperazin-4-ium-1-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-7-carboxylic acid CAS Name: 9-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2,3-dihydro-1H-cyclopenta[b]quinoline-7-carboxylic acid IUPAC Name: 9-(4-benzhydrylpiperazin-4-ium-1-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-7-carboxylic acid Traditional Name: 9-(4-benzhydrylpiperazin-4-ium-1-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-7-carboxylic acid Formula: C30H30N3O2+ MolecularWeight: 464.5781

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=C(C=CC(=C3)C(=O)O)N=C2C1)N4CC[NH+](CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CC2=C(C3=C(C=CC(=C3)C(=O)O)N=C2C1)N4CC[NH+](CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C30H29N3O2/c34-30(35)23-14-15-27-25(20-23)29(24-12-7-13-26(24)31-27)33-18-16-32(17-19-33)28(21-8-3-1-4-9-21)22-10-5-2-6-11-22/h1-6,8-11,14-15,20,28H,7,12-13,16-19H2,(H,34,35)/p+1