ethyl 1-(3-chloranyl-4-methoxy-phenyl)-2-methyl-5-propanoyloxy-indole-3-carboxylate

Systemtic Name: ethyl 1-(3-chloranyl-4-methoxy-phenyl)-2-methyl-5-propanoyloxy-indole-3-carboxylate Openeye Name: ethyl 1-(3-chloro-4-methoxy-phenyl)-2-methyl-5-propanoyloxy-indole-3-carboxylate CAS Name: 1-(3-chloro-4-methoxyphenyl)-2-methyl-5-(1-oxopropoxy)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-chloro-4-methoxyphenyl)-2-methyl-5-propanoyloxyindole-3-carboxylate Traditional Name: 1-(3-chloro-4-methoxy-phenyl)-2-methyl-5-propionyloxy-indole-3-carboxylic acid ethyl ester Formula: C22H22ClNO5 MolecularWeight: 415.86678

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC2=C(C=C1)N(C(=C2C(=O)OCC)C)C3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CCC(=O)OC1=CC2=C(C=C1)N(C(=C2C(=O)OCC)C)C3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C22H22ClNO5/c1-5-20(25)29-15-8-9-18-16(12-15)21(22(26)28-6-2)13(3)24(18)14-7-10-19(27-4)17(23)11-14/h7-12H,5-6H2,1-4H3