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

Systemtic Name: ethyl 8-bromanyl-3-methyl-4,5-bis(oxidanylidene)-2-[(propan-2-ylamino)methyl]benzo[e]indole-1-carboxylate Openeye Name: ethyl 8-bromo-2-[(isopropylamino)methyl]-3-methyl-4,5-dioxo-benzo[e]indole-1-carboxylate CAS Name: 8-bromo-3-methyl-4,5-dioxo-2-[(propan-2-ylamino)methyl]-1-benzo[e]indolecarboxylic acid ethyl ester IUPAC Name: ethyl 8-bromo-3-methyl-4,5-dioxo-2-[(propan-2-ylamino)methyl]benzo[e]indole-1-carboxylate Traditional Name: 8-bromo-2-[(isopropylamino)methyl]-4,5-diketo-3-methyl-benz[e]indole-1-carboxylic acid ethyl ester Formula: C20H21BrN2O4 MolecularWeight: 433.29574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C3=C(C=CC(=C3)Br)C(=O)C2=O)C)CNC(C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C3=C(C=CC(=C3)Br)C(=O)C2=O)C)CNC(C)C

InChI

InChI=1S/C20H21BrN2O4/c1-5-27-20(26)16-14(9-22-10(2)3)23(4)17-15(16)13-8-11(21)6-7-12(13)18(24)19(17)25/h6-8,10,22H,5,9H2,1-4H3