ethyl 5-butanoyloxy-1,2-dimethyl-benzo[g]indole-3-carboxylate

Systemtic Name: ethyl 5-butanoyloxy-1,2-dimethyl-benzo[g]indole-3-carboxylate Openeye Name: ethyl 5-butanoyloxy-1,2-dimethyl-benzo[g]indole-3-carboxylate CAS Name: 1,2-dimethyl-5-(1-oxobutoxy)-3-benzo[g]indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-butanoyloxy-1,2-dimethylbenzo[g]indole-3-carboxylate Traditional Name: 5-butyryloxy-1,2-dimethyl-benz[g]indole-3-carboxylic acid ethyl ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC2=C(C3=CC=CC=C31)N(C(=C2C(=O)OCC)C)C

Isomeric SMILES

CCCC(=O)OC1=CC2=C(C3=CC=CC=C31)N(C(=C2C(=O)OCC)C)C

InChI

InChI=1S/C21H23NO4/c1-5-9-18(23)26-17-12-16-19(21(24)25-6-2)13(3)22(4)20(16)15-11-8-7-10-14(15)17/h7-8,10-12H,5-6,9H2,1-4H3