methyl 6-[[dipyridin-2-ylmethyl-[(5-methoxycarbonylpyridin-2-yl)methyl]amino]methyl]pyridine-3-carboxylate

Systemtic Name: methyl 6-[[dipyridin-2-ylmethyl-[(5-methoxycarbonylpyridin-2-yl)methyl]amino]methyl]pyridine-3-carboxylate Openeye Name: methyl 6-[[bis(2-pyridyl)methyl-[(5-methoxycarbonyl-2-pyridyl)methyl]amino]methyl]pyridine-3-carboxylate CAS Name: 6-[[bis(2-pyridinyl)methyl-[(5-methoxycarbonyl-2-pyridinyl)methyl]amino]methyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[[dipyridin-2-ylmethyl-[(5-methoxycarbonylpyridin-2-yl)methyl]amino]methyl]pyridine-3-carboxylate Traditional Name: 6-[[bis(2-pyridyl)methyl-[(5-carbomethoxy-2-pyridyl)methyl]amino]methyl]nicotinic acid methyl ester Formula: C27H25N5O4 MolecularWeight: 483.5185

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C=C1)CN(CC2=NC=C(C=C2)C(=O)OC)C(C3=CC=CC=N3)C4=CC=CC=N4

Isomeric SMILES

COC(=O)C1=CN=C(C=C1)CN(CC2=NC=C(C=C2)C(=O)OC)C(C3=CC=CC=N3)C4=CC=CC=N4

InChI

InChI=1S/C27H25N5O4/c1-35-26(33)19-9-11-21(30-15-19)17-32(18-22-12-10-20(16-31-22)27(34)36-2)25(23-7-3-5-13-28-23)24-8-4-6-14-29-24/h3-16,25H,17-18H2,1-2H3