[3-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-4,7-dimethyl-2-oxidanylidene-chromen-5-yl] ethanoate

Systemtic Name: [3-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-4,7-dimethyl-2-oxidanylidene-chromen-5-yl] ethanoate Openeye Name: [3-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-4,7-dimethyl-2-oxo-chromen-5-yl] acetate CAS Name: acetic acid [3-[2-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2-oxoethyl]-4,7-dimethyl-2-oxo-1-benzopyran-5-yl] ester IUPAC Name: [3-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxoethyl]-4,7-dimethyl-2-oxochromen-5-yl] acetate Traditional Name: acetic acid [3-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-keto-ethyl]-2-keto-4,7-dimethyl-chromen-5-yl] ester Formula: C32H33N2O5+ MolecularWeight: 525.61482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)CC(=O)N3CC[NH+](CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C)C(=C1)OC(=O)C

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC(=O)N3CC[NH+](CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C)C(=C1)OC(=O)C

InChI

InChI=1S/C32H32N2O5/c1-21-18-27(38-23(3)35)30-22(2)26(32(37)39-28(30)19-21)20-29(36)33-14-16-34(17-15-33)31(24-10-6-4-7-11-24)25-12-8-5-9-13-25/h4-13,18-19,31H,14-17,20H2,1-3H3/p+1