2-[[9,10-bis(oxidanylidene)anthracen-1-yl]carbamoylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[9,10-bis(oxidanylidene)anthracen-1-yl]carbamoylamino]-4-methyl-pentanoic acid Openeye Name: 2-[(9,10-dioxo-1-anthryl)carbamoylamino]-4-methyl-pentanoic acid CAS Name: 2-[[[(9,10-dioxo-1-anthracenyl)amino]-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[(9,10-dioxoanthracen-1-yl)carbamoylamino]-4-methylpentanoic acid Traditional Name: 2-[(9,10-diketo-1-anthryl)carbamoylamino]-4-methyl-valeric acid Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)NC1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)NC1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H20N2O5/c1-11(2)10-16(20(26)27)23-21(28)22-15-9-5-8-14-17(15)19(25)13-7-4-3-6-12(13)18(14)24/h3-9,11,16H,10H2,1-2H3,(H,26,27)(H2,22,23,28)