ethyl 2-[1-[(2-chlorophenyl)methyl]-3-(2-methylpropanoyl)-2-propyl-indol-6-yl]ethanoate

Systemtic Name: ethyl 2-[1-[(2-chlorophenyl)methyl]-3-(2-methylpropanoyl)-2-propyl-indol-6-yl]ethanoate Openeye Name: ethyl 2-[1-[(2-chlorophenyl)methyl]-3-(2-methylpropanoyl)-2-propyl-indol-6-yl]acetate CAS Name: 2-[1-[(2-chlorophenyl)methyl]-3-(2-methyl-1-oxopropyl)-2-propyl-6-indolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-[(2-chlorophenyl)methyl]-3-(2-methylpropanoyl)-2-propylindol-6-yl]acetate Traditional Name: 2-[1-(2-chlorobenzyl)-3-isobutyryl-2-propyl-indol-6-yl]acetic acid ethyl ester Formula: C26H30ClNO3 MolecularWeight: 439.9743

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(N1CC3=CC=CC=C3Cl)C=C(C=C2)CC(=O)OCC)C(=O)C(C)C

Isomeric SMILES

CCCC1=C(C2=C(N1CC3=CC=CC=C3Cl)C=C(C=C2)CC(=O)OCC)C(=O)C(C)C

InChI

InChI=1S/C26H30ClNO3/c1-5-9-22-25(26(30)17(3)4)20-13-12-18(15-24(29)31-6-2)14-23(20)28(22)16-19-10-7-8-11-21(19)27/h7-8,10-14,17H,5-6,9,15-16H2,1-4H3