3-[azanyl-[4-(diphenylmethyl)piperazin-4-ium-1-yl]methylidene]pentane-2,4-dione

Systemtic Name: 3-[azanyl-[4-(diphenylmethyl)piperazin-4-ium-1-yl]methylidene]pentane-2,4-dione Openeye Name: 3-[amino-(4-benzhydrylpiperazin-4-ium-1-yl)methylene]pentane-2,4-dione CAS Name: 3-[amino-[4-(diphenylmethyl)-1-piperazin-4-iumyl]methylidene]pentane-2,4-dione IUPAC Name: 3-[amino-(4-benzhydrylpiperazin-4-ium-1-yl)methylidene]pentane-2,4-dione Traditional Name: 3-[amino-(4-benzhydrylpiperazin-4-ium-1-yl)methylene]pentane-2,4-dione Formula: C23H28N3O2+ MolecularWeight: 378.48732

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C(N)N1CC[NH+](CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C

Isomeric SMILES

CC(=O)C(=C(N)N1CC[NH+](CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C23H27N3O2/c1-17(27)21(18(2)28)23(24)26-15-13-25(14-16-26)22(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-12,22H,13-16,24H2,1-2H3/p+1