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

Systemtic Name: methyl 2-[[[3-(2-methylpropanoyl)-2-propyl-1H-indol-6-yl]carbonylamino]methyl]benzoate Openeye Name: methyl 2-[[[3-(2-methylpropanoyl)-2-propyl-1H-indole-6-carbonyl]amino]methyl]benzoate CAS Name: 2-[[[[3-(2-methyl-1-oxopropyl)-2-propyl-1H-indol-6-yl]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[[3-(2-methylpropanoyl)-2-propyl-1H-indole-6-carbonyl]amino]methyl]benzoate Traditional Name: 2-[[(3-isobutyryl-2-propyl-1H-indole-6-carbonyl)amino]methyl]benzoic acid methyl ester Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(N1)C=C(C=C2)C(=O)NCC3=CC=CC=C3C(=O)OC)C(=O)C(C)C

Isomeric SMILES

CCCC1=C(C2=C(N1)C=C(C=C2)C(=O)NCC3=CC=CC=C3C(=O)OC)C(=O)C(C)C

InChI

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