N-[8-azanyl-9,10-bis(oxidanylidene)anthracen-1-yl]-3-nitro-benzamide

Systemtic Name: N-[8-azanyl-9,10-bis(oxidanylidene)anthracen-1-yl]-3-nitro-benzamide Openeye Name: N-(8-amino-9,10-dioxo-1-anthryl)-3-nitro-benzamide CAS Name: N-(8-amino-9,10-dioxo-1-anthracenyl)-3-nitrobenzamide IUPAC Name: N-(8-amino-9,10-dioxoanthracen-1-yl)-3-nitrobenzamide Traditional Name: N-(8-amino-9,10-diketo-1-anthryl)-3-nitro-benzamide Formula: C21H13N3O5 MolecularWeight: 387.34502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C=CC=C4N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C=CC=C4N

InChI

InChI=1S/C21H13N3O5/c22-15-8-2-6-13-17(15)20(26)18-14(19(13)25)7-3-9-16(18)23-21(27)11-4-1-5-12(10-11)24(28)29/h1-10H,22H2,(H,23,27)