methyl 4-[6-aminocarbonyl-3-(2-methylpropanoyl)-2-propyl-indol-1-yl]carbonyl-3-chloranyl-benzoate

Systemtic Name: methyl 4-[6-aminocarbonyl-3-(2-methylpropanoyl)-2-propyl-indol-1-yl]carbonyl-3-chloranyl-benzoate Openeye Name: methyl 4-[6-carbamoyl-3-(2-methylpropanoyl)-2-propyl-indole-1-carbonyl]-3-chloro-benzoate CAS Name: 4-[[6-carbamoyl-3-(2-methyl-1-oxopropyl)-2-propyl-1-indolyl]-oxomethyl]-3-chlorobenzoic acid methyl ester IUPAC Name: methyl 4-[6-carbamoyl-3-(2-methylpropanoyl)-2-propylindole-1-carbonyl]-3-chlorobenzoate Traditional Name: 4-(6-carbamoyl-3-isobutyryl-2-propyl-indole-1-carbonyl)-3-chloro-benzoic acid methyl ester Formula: C25H25ClN2O5 MolecularWeight: 468.9294

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(N1C(=O)C3=C(C=C(C=C3)C(=O)OC)Cl)C=C(C=C2)C(=O)N)C(=O)C(C)C

Isomeric SMILES

CCCC1=C(C2=C(N1C(=O)C3=C(C=C(C=C3)C(=O)OC)Cl)C=C(C=C2)C(=O)N)C(=O)C(C)C

InChI

InChI=1S/C25H25ClN2O5/c1-5-6-19-21(22(29)13(2)3)17-10-7-14(23(27)30)12-20(17)28(19)24(31)16-9-8-15(11-18(16)26)25(32)33-4/h7-13H,5-6H2,1-4H3,(H2,27,30)