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

Systemtic Name: 3-[(1S)-3,9-bis(oxidanylidene)-1-pyridin-3-yl-1H-chromeno[2,3-c]pyrrol-2-yl]propyl-diethyl-azanium Openeye Name: 3-[(1S)-3,9-dioxo-1-(3-pyridyl)-1H-chromeno[2,3-c]pyrrol-2-yl]propyl-diethyl-ammonium CAS Name: 3-[(1S)-3,9-dioxo-1-(3-pyridinyl)-1H-[1]benzopyrano[2,3-c]pyrrol-2-yl]propyl-diethylammonium IUPAC Name: 3-[(1S)-3,9-dioxo-1-pyridin-3-yl-1H-chromeno[2,3-c]pyrrol-2-yl]propyl-diethylazanium Traditional Name: 3-[(1S)-3,9-diketo-1-(3-pyridyl)-1H-chromeno[2,3-c]pyrrol-2-yl]propyl-diethyl-ammonium Formula: C23H26N3O3+ MolecularWeight: 392.47084

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN1C(C2=C(C1=O)OC3=CC=CC=C3C2=O)C4=CN=CC=C4

Isomeric SMILES

CC[NH+](CC)CCCN1[C@H](C2=C(C1=O)OC3=CC=CC=C3C2=O)C4=CN=CC=C4

InChI

InChI=1S/C23H25N3O3/c1-3-25(4-2)13-8-14-26-20(16-9-7-12-24-15-16)19-21(27)17-10-5-6-11-18(17)29-22(19)23(26)28/h5-7,9-12,15,20H,3-4,8,13-14H2,1-2H3/p+1/t20-/m0/s1