carboxy-[3-[[4-(4-naphthalen-2-ylpyrimidin-2-yl)piperazin-1-yl]methyl]pentan-3-yl]carbamic acid

Systemtic Name: carboxy-[3-[[4-(4-naphthalen-2-ylpyrimidin-2-yl)piperazin-1-yl]methyl]pentan-3-yl]carbamic acid Openeye Name: carboxy-[1-ethyl-1-[[4-[4-(2-naphthyl)pyrimidin-2-yl]piperazin-1-yl]methyl]propyl]carbamic acid CAS Name: carboxy-[3-[[4-[4-(2-naphthalenyl)-2-pyrimidinyl]-1-piperazinyl]methyl]pentan-3-yl]carbamic acid IUPAC Name: carboxy-[3-[[4-(4-naphthalen-2-ylpyrimidin-2-yl)piperazin-1-yl]methyl]pentan-3-yl]carbamic acid Traditional Name: carboxy-[1-ethyl-1-[[4-[4-(2-naphthyl)pyrimidin-2-yl]piperazino]methyl]propyl]carbamic acid Formula: C26H31N5O4 MolecularWeight: 477.55544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CN1CCN(CC1)C2=NC=CC(=N2)C3=CC4=CC=CC=C4C=C3)N(C(=O)O)C(=O)O

Isomeric SMILES

CCC(CC)(CN1CCN(CC1)C2=NC=CC(=N2)C3=CC4=CC=CC=C4C=C3)N(C(=O)O)C(=O)O

InChI

InChI=1S/C26H31N5O4/c1-3-26(4-2,31(24(32)33)25(34)35)18-29-13-15-30(16-14-29)23-27-12-11-22(28-23)21-10-9-19-7-5-6-8-20(19)17-21/h5-12,17H,3-4,13-16,18H2,1-2H3,(H,32,33)(H,34,35)