1-[(3,4-dichlorophenyl)methyl]-4-(morpholin-4-ylmethyl)indole-2-carboxylic acid

Systemtic Name: 1-[(3,4-dichlorophenyl)methyl]-4-(morpholin-4-ylmethyl)indole-2-carboxylic acid Openeye Name: 1-[(3,4-dichlorophenyl)methyl]-4-(morpholinomethyl)indole-2-carboxylic acid CAS Name: 1-[(3,4-dichlorophenyl)methyl]-4-(4-morpholinylmethyl)-2-indolecarboxylic acid IUPAC Name: 1-[(3,4-dichlorophenyl)methyl]-4-(morpholin-4-ylmethyl)indole-2-carboxylic acid Traditional Name: 1-(3,4-dichlorobenzyl)-4-(morpholinomethyl)indole-2-carboxylic acid Formula: C21H20Cl2N2O3 MolecularWeight: 419.3011

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=C3C=C(N(C3=CC=C2)CC4=CC(=C(C=C4)Cl)Cl)C(=O)O

Isomeric SMILES

C1COCCN1CC2=C3C=C(N(C3=CC=C2)CC4=CC(=C(C=C4)Cl)Cl)C(=O)O

InChI

InChI=1S/C21H20Cl2N2O3/c22-17-5-4-14(10-18(17)23)12-25-19-3-1-2-15(13-24-6-8-28-9-7-24)16(19)11-20(25)21(26)27/h1-5,10-11H,6-9,12-13H2,(H,26,27)