1-[(3-methoxyphenyl)methyl]-2,5-dimethyl-4-(propylaminomethyl)pyrrole-3-carboxylic acid

Systemtic Name: 1-[(3-methoxyphenyl)methyl]-2,5-dimethyl-4-(propylaminomethyl)pyrrole-3-carboxylic acid Openeye Name: 1-[(3-methoxyphenyl)methyl]-2,5-dimethyl-4-(propylaminomethyl)pyrrole-3-carboxylic acid CAS Name: 1-[(3-methoxyphenyl)methyl]-2,5-dimethyl-4-(propylaminomethyl)-3-pyrrolecarboxylic acid IUPAC Name: 1-[(3-methoxyphenyl)methyl]-2,5-dimethyl-4-(propylaminomethyl)pyrrole-3-carboxylic acid Traditional Name: 1-m-anisyl-2,5-dimethyl-4-(propylaminomethyl)pyrrole-3-carboxylic acid Formula: C19H26N2O3 MolecularWeight: 330.42134

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=C(N(C(=C1C(=O)O)C)CC2=CC(=CC=C2)OC)C

Isomeric SMILES

CCCNCC1=C(N(C(=C1C(=O)O)C)CC2=CC(=CC=C2)OC)C

InChI

InChI=1S/C19H26N2O3/c1-5-9-20-11-17-13(2)21(14(3)18(17)19(22)23)12-15-7-6-8-16(10-15)24-4/h6-8,10,20H,5,9,11-12H2,1-4H3,(H,22,23)