5-(4-azanylpiperidin-1-yl)carbonyl-4-[(3,4-dichlorophenyl)methoxy]-1-methyl-pyrrole-3-carboxylic acid

Systemtic Name: 5-(4-azanylpiperidin-1-yl)carbonyl-4-[(3,4-dichlorophenyl)methoxy]-1-methyl-pyrrole-3-carboxylic acid Openeye Name: 5-(4-aminopiperidine-1-carbonyl)-4-[(3,4-dichlorophenyl)methoxy]-1-methyl-pyrrole-3-carboxylic acid CAS Name: 5-[(4-amino-1-piperidinyl)-oxomethyl]-4-[(3,4-dichlorophenyl)methoxy]-1-methyl-3-pyrrolecarboxylic acid IUPAC Name: 5-(4-aminopiperidine-1-carbonyl)-4-[(3,4-dichlorophenyl)methoxy]-1-methylpyrrole-3-carboxylic acid Traditional Name: 5-(4-aminopiperidine-1-carbonyl)-4-(3,4-dichlorobenzyl)oxy-1-methyl-pyrrole-3-carboxylic acid Formula: C19H21Cl2N3O4 MolecularWeight: 426.29374

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=C1C(=O)N2CCC(CC2)N)OCC3=CC(=C(C=C3)Cl)Cl)C(=O)O

Isomeric SMILES

CN1C=C(C(=C1C(=O)N2CCC(CC2)N)OCC3=CC(=C(C=C3)Cl)Cl)C(=O)O

InChI

InChI=1S/C19H21Cl2N3O4/c1-23-9-13(19(26)27)17(28-10-11-2-3-14(20)15(21)8-11)16(23)18(25)24-6-4-12(22)5-7-24/h2-3,8-9,12H,4-7,10,22H2,1H3,(H,26,27)