(1S)-2-(2-morpholin-4-ium-4-ylethyl)-1-pyridin-3-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione

Systemtic Name: (1S)-2-(2-morpholin-4-ium-4-ylethyl)-1-pyridin-3-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione Openeye Name: (1S)-2-(2-morpholin-4-ium-4-ylethyl)-1-(3-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione CAS Name: (1S)-2-[2-(4-morpholin-4-iumyl)ethyl]-1-(3-pyridinyl)-1H-[1]benzopyrano[2,3-c]pyrrole-3,9-dione IUPAC Name: (1S)-2-(2-morpholin-4-ium-4-ylethyl)-1-pyridin-3-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione Traditional Name: (1S)-2-(2-morpholin-4-ium-4-ylethyl)-1-(3-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-quinone Formula: C22H22N3O4+ MolecularWeight: 392.42778

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN2C(C3=C(C2=O)OC4=CC=CC=C4C3=O)C5=CN=CC=C5

Isomeric SMILES

C1COCC[NH+]1CCN2[C@H](C3=C(C2=O)OC4=CC=CC=C4C3=O)C5=CN=CC=C5

InChI

InChI=1S/C22H21N3O4/c26-20-16-5-1-2-6-17(16)29-21-18(20)19(15-4-3-7-23-14-15)25(22(21)27)9-8-24-10-12-28-13-11-24/h1-7,14,19H,8-13H2/p+1/t19-/m0/s1