methyl N-[8-azanyl-5-oxidanyl-9,10-bis(oxidanylidene)-4-[(4-phenoxyphenyl)amino]anthracen-1-yl]carbamate

Systemtic Name: methyl N-[8-azanyl-5-oxidanyl-9,10-bis(oxidanylidene)-4-[(4-phenoxyphenyl)amino]anthracen-1-yl]carbamate Openeye Name: methyl N-[8-amino-5-hydroxy-9,10-dioxo-4-(4-phenoxyanilino)-1-anthryl]carbamate CAS Name: N-[8-amino-5-hydroxy-9,10-dioxo-4-(4-phenoxyanilino)-1-anthracenyl]carbamic acid methyl ester IUPAC Name: methyl N-[8-amino-5-hydroxy-9,10-dioxo-4-(4-phenoxyanilino)anthracen-1-yl]carbamate Traditional Name: N-[8-amino-5-hydroxy-9,10-diketo-4-(4-phenoxyanilino)-1-anthryl]carbamic acid methyl ester Formula: C28H21N3O6 MolecularWeight: 495.48284

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=C2C(=C(C=C1)NC3=CC=C(C=C3)OC4=CC=CC=C4)C(=O)C5=C(C=CC(=C5C2=O)N)O

Isomeric SMILES

COC(=O)NC1=C2C(=C(C=C1)NC3=CC=C(C=C3)OC4=CC=CC=C4)C(=O)C5=C(C=CC(=C5C2=O)N)O

InChI

InChI=1S/C28H21N3O6/c1-36-28(35)31-20-13-12-19(30-15-7-9-17(10-8-15)37-16-5-3-2-4-6-16)23-24(20)26(33)22-18(29)11-14-21(32)25(22)27(23)34/h2-14,30,32H,29H2,1H3,(H,31,35)