3-[(3,4-dichlorophenyl)methyl]-4-(2-dimethylaminoethyloxy)-1H-indole-2-carboxylic acid

Systemtic Name: 3-[(3,4-dichlorophenyl)methyl]-4-(2-dimethylaminoethyloxy)-1H-indole-2-carboxylic acid Openeye Name: 3-[(3,4-dichlorophenyl)methyl]-4-(2-dimethylaminoethyloxy)-1H-indole-2-carboxylic acid CAS Name: 3-[(3,4-dichlorophenyl)methyl]-4-(2-dimethylaminoethyloxy)-1H-indole-2-carboxylic acid IUPAC Name: 3-[(3,4-dichlorophenyl)methyl]-4-(2-dimethylaminoethyloxy)-1H-indole-2-carboxylic acid Traditional Name: 3-(3,4-dichlorobenzyl)-4-(2-dimethylaminoethyloxy)-1H-indole-2-carboxylic acid Formula: C20H20Cl2N2O3 MolecularWeight: 407.2904

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=CC=CC2=C1C(=C(N2)C(=O)O)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CN(C)CCOC1=CC=CC2=C1C(=C(N2)C(=O)O)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H20Cl2N2O3/c1-24(2)8-9-27-17-5-3-4-16-18(17)13(19(23-16)20(25)26)10-12-6-7-14(21)15(22)11-12/h3-7,11,23H,8-10H2,1-2H3,(H,25,26)