8-oxidanylidene-3-(thiophen-2-ylmethylamino)acenaphthyleno[1,2-b]pyrrole-9-carboxylic acid

Systemtic Name: 8-oxidanylidene-3-(thiophen-2-ylmethylamino)acenaphthyleno[1,2-b]pyrrole-9-carboxylic acid Openeye Name: 8-oxo-3-(2-thienylmethylamino)acenaphthyleno[1,2-b]pyrrole-9-carboxylic acid CAS Name: 8-oxo-3-(thiophen-2-ylmethylamino)-9-acenaphthyleno[1,2-b]pyrrolecarboxylic acid IUPAC Name: 8-oxo-3-(thiophen-2-ylmethylamino)acenaphthyleno[1,2-b]pyrrole-9-carboxylic acid Traditional Name: 8-keto-3-(2-thenylamino)acenaphtho[1,2-b]pyrrole-9-carboxylic acid Formula: C20H12N2O3S MolecularWeight: 360.38588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC3=C2C(=C1)C4=NC(=O)C(=C34)C(=O)O)NCC5=CC=CS5

Isomeric SMILES

C1=CC2=C(C=CC3=C2C(=C1)C4=NC(=O)C(=C34)C(=O)O)NCC5=CC=CS5

InChI

InChI=1S/C20H12N2O3S/c23-19-17(20(24)25)16-12-6-7-14(21-9-10-3-2-8-26-10)11-4-1-5-13(15(11)12)18(16)22-19/h1-8,21H,9H2,(H,24,25)