2-[2-[(4-aminophenyl)methyl]-4-methyl-6-pyrrolidin-1-yl-pyrimidin-5-yl]ethanoic acid

Systemtic Name: 2-[2-[(4-aminophenyl)methyl]-4-methyl-6-pyrrolidin-1-yl-pyrimidin-5-yl]ethanoic acid Openeye Name: 2-[2-[(4-aminophenyl)methyl]-4-methyl-6-pyrrolidin-1-yl-pyrimidin-5-yl]acetic acid CAS Name: 2-[2-[(4-aminophenyl)methyl]-4-methyl-6-(1-pyrrolidinyl)-5-pyrimidinyl]acetic acid IUPAC Name: 2-[2-[(4-aminophenyl)methyl]-4-methyl-6-pyrrolidin-1-ylpyrimidin-5-yl]acetic acid Traditional Name: 2-[2-(4-aminobenzyl)-4-methyl-6-pyrrolidino-pyrimidin-5-yl]acetic acid Formula: C18H22N4O2 MolecularWeight: 326.39288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)CC2=CC=C(C=C2)N)N3CCCC3)CC(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)CC2=CC=C(C=C2)N)N3CCCC3)CC(=O)O

InChI

InChI=1S/C18H22N4O2/c1-12-15(11-17(23)24)18(22-8-2-3-9-22)21-16(20-12)10-13-4-6-14(19)7-5-13/h4-7H,2-3,8-11,19H2,1H3,(H,23,24)