methyl 1-[(2-chloranyl-1-benzothiophen-3-yl)methyl]-2-methyl-3-(2-methylpropanoyl)indole-6-carboxylate

Systemtic Name: methyl 1-[(2-chloranyl-1-benzothiophen-3-yl)methyl]-2-methyl-3-(2-methylpropanoyl)indole-6-carboxylate Openeye Name: methyl 1-[(2-chlorobenzothiophen-3-yl)methyl]-2-methyl-3-(2-methylpropanoyl)indole-6-carboxylate CAS Name: 1-[(2-chloro-1-benzothiophen-3-yl)methyl]-2-methyl-3-(2-methyl-1-oxopropyl)-6-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[(2-chloro-1-benzothiophen-3-yl)methyl]-2-methyl-3-(2-methylpropanoyl)indole-6-carboxylate Traditional Name: 1-[(2-chlorobenzothiophen-3-yl)methyl]-3-isobutyryl-2-methyl-indole-6-carboxylic acid methyl ester Formula: C24H22ClNO3S MolecularWeight: 439.95438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=C(SC4=CC=CC=C43)Cl)C=C(C=C2)C(=O)OC)C(=O)C(C)C

Isomeric SMILES

CC1=C(C2=C(N1CC3=C(SC4=CC=CC=C43)Cl)C=C(C=C2)C(=O)OC)C(=O)C(C)C

InChI

InChI=1S/C24H22ClNO3S/c1-13(2)22(27)21-14(3)26(19-11-15(24(28)29-4)9-10-17(19)21)12-18-16-7-5-6-8-20(16)30-23(18)25/h5-11,13H,12H2,1-4H3