4-[1-[(2-chlorophenyl)methyl]-6-methoxycarbonyl-indol-2-yl]butanoic acid

Systemtic Name: 4-[1-[(2-chlorophenyl)methyl]-6-methoxycarbonyl-indol-2-yl]butanoic acid Openeye Name: 4-[1-[(2-chlorophenyl)methyl]-6-methoxycarbonyl-indol-2-yl]butanoic acid CAS Name: 4-[1-[(2-chlorophenyl)methyl]-6-methoxycarbonyl-2-indolyl]butanoic acid IUPAC Name: 4-[1-[(2-chlorophenyl)methyl]-6-methoxycarbonylindol-2-yl]butanoic acid Traditional Name: 4-[6-carbomethoxy-1-(2-chlorobenzyl)indol-2-yl]butyric acid Formula: C21H20ClNO4 MolecularWeight: 385.8408

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C=C(N2CC3=CC=CC=C3Cl)CCCC(=O)O

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C=C(N2CC3=CC=CC=C3Cl)CCCC(=O)O

InChI

InChI=1S/C21H20ClNO4/c1-27-21(26)15-10-9-14-11-17(6-4-8-20(24)25)23(19(14)12-15)13-16-5-2-3-7-18(16)22/h2-3,5,7,9-12H,4,6,8,13H2,1H3,(H,24,25)