2-azanyl-N-[4-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]butyl]ethanamide

Systemtic Name: 2-azanyl-N-[4-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]butyl]ethanamide Openeye Name: 2-amino-N-[4-[(9,10-dioxo-1-anthryl)amino]butyl]acetamide CAS Name: 2-amino-N-[4-[(9,10-dioxo-1-anthracenyl)amino]butyl]acetamide IUPAC Name: 2-amino-N-[4-[(9,10-dioxoanthracen-1-yl)amino]butyl]acetamide Traditional Name: 2-amino-N-[4-[(9,10-diketo-1-anthryl)amino]butyl]acetamide Formula: C20H21N3O3 MolecularWeight: 351.39904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NCCCCNC(=O)CN

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NCCCCNC(=O)CN

InChI

InChI=1S/C20H21N3O3/c21-12-17(24)23-11-4-3-10-22-16-9-5-8-15-18(16)20(26)14-7-2-1-6-13(14)19(15)25/h1-2,5-9,22H,3-4,10-12,21H2,(H,23,24)