ethyl 5-butanoyloxy-2-methyl-1-phenyl-benzo[g]indole-3-carboxylate

Systemtic Name: ethyl 5-butanoyloxy-2-methyl-1-phenyl-benzo[g]indole-3-carboxylate Openeye Name: ethyl 5-butanoyloxy-2-methyl-1-phenyl-benzo[g]indole-3-carboxylate CAS Name: 2-methyl-5-(1-oxobutoxy)-1-phenyl-3-benzo[g]indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-butanoyloxy-2-methyl-1-phenylbenzo[g]indole-3-carboxylate Traditional Name: 5-butyryloxy-2-methyl-1-phenyl-benz[g]indole-3-carboxylic acid ethyl ester Formula: C26H25NO4 MolecularWeight: 415.481

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC2=C(C3=CC=CC=C31)N(C(=C2C(=O)OCC)C)C4=CC=CC=C4

Isomeric SMILES

CCCC(=O)OC1=CC2=C(C3=CC=CC=C31)N(C(=C2C(=O)OCC)C)C4=CC=CC=C4

InChI

InChI=1S/C26H25NO4/c1-4-11-23(28)31-22-16-21-24(26(29)30-5-2)17(3)27(18-12-7-6-8-13-18)25(21)20-15-10-9-14-19(20)22/h6-10,12-16H,4-5,11H2,1-3H3