2-[1-[(3-chlorophenyl)methyl]-5-ethoxycarbonyl-2-methyl-indol-3-yl]ethanoic acid

Systemtic Name: 2-[1-[(3-chlorophenyl)methyl]-5-ethoxycarbonyl-2-methyl-indol-3-yl]ethanoic acid Openeye Name: 2-[1-[(3-chlorophenyl)methyl]-5-ethoxycarbonyl-2-methyl-indol-3-yl]acetic acid CAS Name: 2-[1-[(3-chlorophenyl)methyl]-5-ethoxycarbonyl-2-methyl-3-indolyl]acetic acid IUPAC Name: 2-[1-[(3-chlorophenyl)methyl]-5-ethoxycarbonyl-2-methylindol-3-yl]acetic acid Traditional Name: 2-[5-carbethoxy-1-(3-chlorobenzyl)-2-methyl-indol-3-yl]acetic acid Formula: C21H20ClNO4 MolecularWeight: 385.8408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=C2CC(=O)O)C)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=C2CC(=O)O)C)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H20ClNO4/c1-3-27-21(26)15-7-8-19-18(10-15)17(11-20(24)25)13(2)23(19)12-14-5-4-6-16(22)9-14/h4-10H,3,11-12H2,1-2H3,(H,24,25)