ethyl 1-butyl-2-methyl-5-(2-phenylethanoyloxy)benzo[g]indole-3-carboxylate

Systemtic Name: ethyl 1-butyl-2-methyl-5-(2-phenylethanoyloxy)benzo[g]indole-3-carboxylate Openeye Name: ethyl 1-butyl-2-methyl-5-(2-phenylacetyl)oxy-benzo[g]indole-3-carboxylate CAS Name: 1-butyl-2-methyl-5-(1-oxo-2-phenylethoxy)-3-benzo[g]indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-butyl-2-methyl-5-(2-phenylacetyl)oxybenzo[g]indole-3-carboxylate Traditional Name: 1-butyl-2-methyl-5-(2-phenylacetyl)oxy-benz[g]indole-3-carboxylic acid ethyl ester Formula: C28H29NO4 MolecularWeight: 443.53416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C2=C1C3=CC=CC=C3C(=C2)OC(=O)CC4=CC=CC=C4)C(=O)OCC)C

Isomeric SMILES

CCCCN1C(=C(C2=C1C3=CC=CC=C3C(=C2)OC(=O)CC4=CC=CC=C4)C(=O)OCC)C

InChI

InChI=1S/C28H29NO4/c1-4-6-16-29-19(3)26(28(31)32-5-2)23-18-24(21-14-10-11-15-22(21)27(23)29)33-25(30)17-20-12-8-7-9-13-20/h7-15,18H,4-6,16-17H2,1-3H3