2-[[9,10-bis(oxidanylidene)anthracen-1-yl]carbamoylamino]-3-methyl-pentanoic acid

Systemtic Name: 2-[[9,10-bis(oxidanylidene)anthracen-1-yl]carbamoylamino]-3-methyl-pentanoic acid Openeye Name: 2-[(9,10-dioxo-1-anthryl)carbamoylamino]-3-methyl-pentanoic acid CAS Name: 2-[[[(9,10-dioxo-1-anthracenyl)amino]-oxomethyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[(9,10-dioxoanthracen-1-yl)carbamoylamino]-3-methylpentanoic acid Traditional Name: 2-[(9,10-diketo-1-anthryl)carbamoylamino]-3-methyl-valeric acid Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O5/c1-3-11(2)17(20(26)27)23-21(28)22-15-10-6-9-14-16(15)19(25)13-8-5-4-7-12(13)18(14)24/h4-11,17H,3H2,1-2H3,(H,26,27)(H2,22,23,28)