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

Systemtic Name: 3-[3-(dimethylamino)propylamino]-8-oxidanylidene-acenaphthyleno[1,2-b]pyrrole-9-carboxylic acid Openeye Name: 3-[3-(dimethylamino)propylamino]-8-oxo-acenaphthyleno[1,2-b]pyrrole-9-carboxylic acid CAS Name: 3-[3-(dimethylamino)propylamino]-8-oxo-9-acenaphthyleno[1,2-b]pyrrolecarboxylic acid IUPAC Name: 3-[3-(dimethylamino)propylamino]-8-oxoacenaphthyleno[1,2-b]pyrrole-9-carboxylic acid Traditional Name: 3-[3-(dimethylamino)propylamino]-8-keto-acenaphtho[1,2-b]pyrrole-9-carboxylic acid Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC1=C2C=CC=C3C2=C(C=C1)C4=C(C(=O)N=C34)C(=O)O

Isomeric SMILES

CN(C)CCCNC1=C2C=CC=C3C2=C(C=C1)C4=C(C(=O)N=C34)C(=O)O

InChI

InChI=1S/C20H19N3O3/c1-23(2)10-4-9-21-14-8-7-12-15-11(14)5-3-6-13(15)18-16(12)17(20(25)26)19(24)22-18/h3,5-8,21H,4,9-10H2,1-2H3,(H,25,26)