3-[(1S)-6-methoxy-3,9-bis(oxidanylidene)-1-pyridin-3-yl-1H-chromeno[2,3-c]pyrrol-2-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[(1S)-6-methoxy-3,9-bis(oxidanylidene)-1-pyridin-3-yl-1H-chromeno[2,3-c]pyrrol-2-yl]propyl-dimethyl-azanium Openeye Name: 3-[(1S)-6-methoxy-3,9-dioxo-1-(3-pyridyl)-1H-chromeno[2,3-c]pyrrol-2-yl]propyl-dimethyl-ammonium CAS Name: 3-[(1S)-6-methoxy-3,9-dioxo-1-(3-pyridinyl)-1H-[1]benzopyrano[2,3-c]pyrrol-2-yl]propyl-dimethylammonium IUPAC Name: 3-[(1S)-6-methoxy-3,9-dioxo-1-pyridin-3-yl-1H-chromeno[2,3-c]pyrrol-2-yl]propyl-dimethylazanium Traditional Name: 3-[(1S)-3,9-diketo-6-methoxy-1-(3-pyridyl)-1H-chromeno[2,3-c]pyrrol-2-yl]propyl-dimethyl-ammonium Formula: C22H24N3O4+ MolecularWeight: 394.44366

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN1C(C2=C(C1=O)OC3=C(C2=O)C=CC(=C3)OC)C4=CN=CC=C4

Isomeric SMILES

C[NH+](C)CCCN1[C@H](C2=C(C1=O)OC3=C(C2=O)C=CC(=C3)OC)C4=CN=CC=C4

InChI

InChI=1S/C22H23N3O4/c1-24(2)10-5-11-25-19(14-6-4-9-23-13-14)18-20(26)16-8-7-15(28-3)12-17(16)29-21(18)22(25)27/h4,6-9,12-13,19H,5,10-11H2,1-3H3/p+1/t19-/m0/s1