3-[(3-chlorophenyl)methyl]-5,6-dimethoxy-1H-indole-2-carboxylic acid

Systemtic Name: 3-[(3-chlorophenyl)methyl]-5,6-dimethoxy-1H-indole-2-carboxylic acid Openeye Name: 3-[(3-chlorophenyl)methyl]-5,6-dimethoxy-1H-indole-2-carboxylic acid CAS Name: 3-[(3-chlorophenyl)methyl]-5,6-dimethoxy-1H-indole-2-carboxylic acid IUPAC Name: 3-[(3-chlorophenyl)methyl]-5,6-dimethoxy-1H-indole-2-carboxylic acid Traditional Name: 3-(3-chlorobenzyl)-5,6-dimethoxy-1H-indole-2-carboxylic acid Formula: C18H16ClNO4 MolecularWeight: 345.77694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(N2)C(=O)O)CC3=CC(=CC=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(N2)C(=O)O)CC3=CC(=CC=C3)Cl)OC

InChI

InChI=1S/C18H16ClNO4/c1-23-15-8-12-13(7-10-4-3-5-11(19)6-10)17(18(21)22)20-14(12)9-16(15)24-2/h3-6,8-9,20H,7H2,1-2H3,(H,21,22)