ethyl N-[8-nitro-9,10-bis(oxidanylidene)-4-(propan-2-ylamino)anthracen-1-yl]carbamate

Systemtic Name: ethyl N-[8-nitro-9,10-bis(oxidanylidene)-4-(propan-2-ylamino)anthracen-1-yl]carbamate Openeye Name: ethyl N-[4-(isopropylamino)-8-nitro-9,10-dioxo-1-anthryl]carbamate CAS Name: N-[8-nitro-9,10-dioxo-4-(propan-2-ylamino)-1-anthracenyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[8-nitro-9,10-dioxo-4-(propan-2-ylamino)anthracen-1-yl]carbamate Traditional Name: N-[4-(isopropylamino)-9,10-diketo-8-nitro-1-anthryl]carbamic acid ethyl ester Formula: C20H19N3O6 MolecularWeight: 397.38136

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=C2C(=C(C=C1)NC(C)C)C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)NC1=C2C(=C(C=C1)NC(C)C)C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O6/c1-4-29-20(26)22-13-9-8-12(21-10(2)3)16-17(13)19(25)15-11(18(16)24)6-5-7-14(15)23(27)28/h5-10,21H,4H2,1-3H3,(H,22,26)