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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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