(3R)-3-[4-(diphenylmethyl)piperazin-1-ium-1-yl]-1-(4-propoxyphenyl)pyrrolidine-2,5-dione

Systemtic Name: (3R)-3-[4-(diphenylmethyl)piperazin-1-ium-1-yl]-1-(4-propoxyphenyl)pyrrolidine-2,5-dione Openeye Name: (3R)-3-(4-benzhydrylpiperazin-1-ium-1-yl)-1-(4-propoxyphenyl)pyrrolidine-2,5-dione CAS Name: (3R)-3-[4-(diphenylmethyl)-1-piperazin-1-iumyl]-1-(4-propoxyphenyl)pyrrolidine-2,5-dione IUPAC Name: (3R)-3-(4-benzhydrylpiperazin-1-ium-1-yl)-1-(4-propoxyphenyl)pyrrolidine-2,5-dione Traditional Name: (3R)-3-(4-benzhydrylpiperazin-1-ium-1-yl)-1-(4-propoxyphenyl)pyrrolidine-2,5-quinone Formula: C30H34N3O3+ MolecularWeight: 484.60926

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH+]3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCOC1=CC=C(C=C1)N2C(=O)C[C@H](C2=O)[NH+]3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H33N3O3/c1-2-21-36-26-15-13-25(14-16-26)33-28(34)22-27(30(33)35)31-17-19-32(20-18-31)29(23-9-5-3-6-10-23)24-11-7-4-8-12-24/h3-16,27,29H,2,17-22H2,1H3/p+1/t27-/m1/s1