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

Systemtic Name: 3-[(1S)-3,9-bis(oxidanylidene)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrol-2-yl]propyl-diethyl-azanium Openeye Name: 3-[(1S)-3,9-dioxo-1-(2-thienyl)-1H-chromeno[2,3-c]pyrrol-2-yl]propyl-diethyl-ammonium CAS Name: 3-[(1S)-3,9-dioxo-1-thiophen-2-yl-1H-[1]benzopyrano[2,3-c]pyrrol-2-yl]propyl-diethylammonium IUPAC Name: 3-[(1S)-3,9-dioxo-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrol-2-yl]propyl-diethylazanium Traditional Name: 3-[(1S)-3,9-diketo-1-(2-thienyl)-1H-chromeno[2,3-c]pyrrol-2-yl]propyl-diethyl-ammonium Formula: C22H25N2O3S+ MolecularWeight: 397.5105

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN1C(C2=C(C1=O)OC3=CC=CC=C3C2=O)C4=CC=CS4

Isomeric SMILES

CC[NH+](CC)CCCN1[C@@H](C2=C(C1=O)OC3=CC=CC=C3C2=O)C4=CC=CS4

InChI

InChI=1S/C22H24N2O3S/c1-3-23(4-2)12-8-13-24-19(17-11-7-14-28-17)18-20(25)15-9-5-6-10-16(15)27-21(18)22(24)26/h5-7,9-11,14,19H,3-4,8,12-13H2,1-2H3/p+1/t19-/m1/s1