ethyl 8-bromanyl-2-(diethylaminomethyl)-3-methyl-4,5-bis(oxidanylidene)benzo[e]indole-1-carboxylate

Systemtic Name: ethyl 8-bromanyl-2-(diethylaminomethyl)-3-methyl-4,5-bis(oxidanylidene)benzo[e]indole-1-carboxylate Openeye Name: ethyl 8-bromo-2-(diethylaminomethyl)-3-methyl-4,5-dioxo-benzo[e]indole-1-carboxylate CAS Name: 8-bromo-2-(diethylaminomethyl)-3-methyl-4,5-dioxo-1-benzo[e]indolecarboxylic acid ethyl ester IUPAC Name: ethyl 8-bromo-2-(diethylaminomethyl)-3-methyl-4,5-dioxobenzo[e]indole-1-carboxylate Traditional Name: 8-bromo-2-(diethylaminomethyl)-4,5-diketo-3-methyl-benz[e]indole-1-carboxylic acid ethyl ester Formula: C21H23BrN2O4 MolecularWeight: 447.32232

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C2=C(N1C)C(=O)C(=O)C3=C2C=C(C=C3)Br)C(=O)OCC

Isomeric SMILES

CCN(CC)CC1=C(C2=C(N1C)C(=O)C(=O)C3=C2C=C(C=C3)Br)C(=O)OCC

InChI

InChI=1S/C21H23BrN2O4/c1-5-24(6-2)11-15-17(21(27)28-7-3)16-14-10-12(22)8-9-13(14)19(25)20(26)18(16)23(15)4/h8-10H,5-7,11H2,1-4H3