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

Systemtic Name: 3-(2-diethylaminoethylamino)-8-oxidanylidene-acenaphthyleno[1,2-b]pyrrole-9-carboxylic acid Openeye Name: 3-(2-diethylaminoethylamino)-8-oxo-acenaphthyleno[1,2-b]pyrrole-9-carboxylic acid CAS Name: 3-(2-diethylaminoethylamino)-8-oxo-9-acenaphthyleno[1,2-b]pyrrolecarboxylic acid IUPAC Name: 3-(2-diethylaminoethylamino)-8-oxoacenaphthyleno[1,2-b]pyrrole-9-carboxylic acid Traditional Name: 3-(2-diethylaminoethylamino)-8-keto-acenaphtho[1,2-b]pyrrole-9-carboxylic acid Formula: C21H21N3O3 MolecularWeight: 363.40974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=C2C=CC=C3C2=C(C=C1)C4=C(C(=O)N=C34)C(=O)O

Isomeric SMILES

CCN(CC)CCNC1=C2C=CC=C3C2=C(C=C1)C4=C(C(=O)N=C34)C(=O)O

InChI

InChI=1S/C21H21N3O3/c1-3-24(4-2)11-10-22-15-9-8-13-16-12(15)6-5-7-14(16)19-17(13)18(21(26)27)20(25)23-19/h5-9,22H,3-4,10-11H2,1-2H3,(H,26,27)