4-(4-chlorophenyl)-3-(2-dimethylaminoethyl)-1-(methylamino)pyrrole-2-carboxylic acid

Systemtic Name: 4-(4-chlorophenyl)-3-(2-dimethylaminoethyl)-1-(methylamino)pyrrole-2-carboxylic acid Openeye Name: 4-(4-chlorophenyl)-3-(2-dimethylaminoethyl)-1-(methylamino)pyrrole-2-carboxylic acid CAS Name: 4-(4-chlorophenyl)-3-(2-dimethylaminoethyl)-1-(methylamino)-2-pyrrolecarboxylic acid IUPAC Name: 4-(4-chlorophenyl)-3-(2-dimethylaminoethyl)-1-(methylamino)pyrrole-2-carboxylic acid Traditional Name: 4-(4-chlorophenyl)-3-(2-dimethylaminoethyl)-1-(methylamino)pyrrole-2-carboxylic acid Formula: C16H20ClN3O2 MolecularWeight: 321.8019

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Descriptors Computed from Structure

Canonical SMILES:

CNN1C=C(C(=C1C(=O)O)CCN(C)C)C2=CC=C(C=C2)Cl

Isomeric SMILES

CNN1C=C(C(=C1C(=O)O)CCN(C)C)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H20ClN3O2/c1-18-20-10-14(11-4-6-12(17)7-5-11)13(8-9-19(2)3)15(20)16(21)22/h4-7,10,18H,8-9H2,1-3H3,(H,21,22)