2-(3,5-dimethylpiperazin-1-yl)-4-naphthalen-1-yl-pyrimidine-5-carboxylic acid

Systemtic Name: 2-(3,5-dimethylpiperazin-1-yl)-4-naphthalen-1-yl-pyrimidine-5-carboxylic acid Openeye Name: 2-(3,5-dimethylpiperazin-1-yl)-4-(1-naphthyl)pyrimidine-5-carboxylic acid CAS Name: 2-(3,5-dimethyl-1-piperazinyl)-4-(1-naphthalenyl)-5-pyrimidinecarboxylic acid IUPAC Name: 2-(3,5-dimethylpiperazin-1-yl)-4-naphthalen-1-ylpyrimidine-5-carboxylic acid Traditional Name: 2-(3,5-dimethylpiperazino)-4-(1-naphthyl)pyrimidine-5-carboxylic acid Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)C2=NC=C(C(=N2)C3=CC=CC4=CC=CC=C43)C(=O)O

Isomeric SMILES

CC1CN(CC(N1)C)C2=NC=C(C(=N2)C3=CC=CC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C21H22N4O2/c1-13-11-25(12-14(2)23-13)21-22-10-18(20(26)27)19(24-21)17-9-5-7-15-6-3-4-8-16(15)17/h3-10,13-14,23H,11-12H2,1-2H3,(H,26,27)