[3-[3-[(4-morpholin-4-ium-4-ylphenyl)amino]-2,5-bis(oxidanylidene)pyrrolidin-1-yl]phenyl] ethanoate

Systemtic Name: [3-[3-[(4-morpholin-4-ium-4-ylphenyl)amino]-2,5-bis(oxidanylidene)pyrrolidin-1-yl]phenyl] ethanoate Openeye Name: [3-[3-(4-morpholin-4-ium-4-ylanilino)-2,5-dioxo-pyrrolidin-1-yl]phenyl] acetate CAS Name: acetic acid [3-[3-[4-(4-morpholin-4-iumyl)anilino]-2,5-dioxo-1-pyrrolidinyl]phenyl] ester IUPAC Name: [3-[3-(4-morpholin-4-ium-4-ylanilino)-2,5-dioxopyrrolidin-1-yl]phenyl] acetate Traditional Name: acetic acid [3-[2,5-diketo-3-(4-morpholin-4-ium-4-ylanilino)pyrrolidino]phenyl] ester Formula: C22H24N3O5+ MolecularWeight: 410.44306

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC(=C1)N2C(=O)CC(C2=O)NC3=CC=C(C=C3)[NH+]4CCOCC4

Isomeric SMILES

CC(=O)OC1=CC=CC(=C1)N2C(=O)CC(C2=O)NC3=CC=C(C=C3)[NH+]4CCOCC4

InChI

InChI=1S/C22H23N3O5/c1-15(26)30-19-4-2-3-18(13-19)25-21(27)14-20(22(25)28)23-16-5-7-17(8-6-16)24-9-11-29-12-10-24/h2-8,13,20,23H,9-12,14H2,1H3/p+1