ethyl 1-butyl-2-methyl-5-pentanoyloxy-benzo[g]indole-3-carboxylate

Systemtic Name: ethyl 1-butyl-2-methyl-5-pentanoyloxy-benzo[g]indole-3-carboxylate Openeye Name: ethyl 1-butyl-2-methyl-5-pentanoyloxy-benzo[g]indole-3-carboxylate CAS Name: 1-butyl-2-methyl-5-(1-oxopentoxy)-3-benzo[g]indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-butyl-2-methyl-5-pentanoyloxybenzo[g]indole-3-carboxylate Traditional Name: 1-butyl-2-methyl-5-valeryloxy-benz[g]indole-3-carboxylic acid ethyl ester Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31NO4/c1-5-8-14-22(27)30-21-16-20-23(25(28)29-7-3)17(4)26(15-9-6-2)24(20)19-13-11-10-12-18(19)21/h10-13,16H,5-9,14-15H2,1-4H3