methyl 2-[[6-aminocarbonyl-3-(2-methylpropanoyl)-2-propyl-indol-1-yl]methyl]benzoate

Systemtic Name: methyl 2-[[6-aminocarbonyl-3-(2-methylpropanoyl)-2-propyl-indol-1-yl]methyl]benzoate Openeye Name: methyl 2-[[6-carbamoyl-3-(2-methylpropanoyl)-2-propyl-indol-1-yl]methyl]benzoate CAS Name: 2-[[6-carbamoyl-3-(2-methyl-1-oxopropyl)-2-propyl-1-indolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[6-carbamoyl-3-(2-methylpropanoyl)-2-propylindol-1-yl]methyl]benzoate Traditional Name: 2-[(6-carbamoyl-3-isobutyryl-2-propyl-indol-1-yl)methyl]benzoic acid methyl ester Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(N1CC3=CC=CC=C3C(=O)OC)C=C(C=C2)C(=O)N)C(=O)C(C)C

Isomeric SMILES

CCCC1=C(C2=C(N1CC3=CC=CC=C3C(=O)OC)C=C(C=C2)C(=O)N)C(=O)C(C)C

InChI

InChI=1S/C25H28N2O4/c1-5-8-20-22(23(28)15(2)3)19-12-11-16(24(26)29)13-21(19)27(20)14-17-9-6-7-10-18(17)25(30)31-4/h6-7,9-13,15H,5,8,14H2,1-4H3,(H2,26,29)