1-[bis(pyridin-2-ylmethyl)amino]-3-[(4-nitropyridin-2-yl)methyl-(pyridin-2-ylmethyl)amino]propan-2-ol

Systemtic Name: 1-[bis(pyridin-2-ylmethyl)amino]-3-[(4-nitropyridin-2-yl)methyl-(pyridin-2-ylmethyl)amino]propan-2-ol Openeye Name: 1-[bis(2-pyridylmethyl)amino]-3-[(4-nitro-2-pyridyl)methyl-(2-pyridylmethyl)amino]propan-2-ol CAS Name: 1-[bis(2-pyridinylmethyl)amino]-3-[(4-nitro-2-pyridinyl)methyl-(2-pyridinylmethyl)amino]-2-propanol IUPAC Name: 1-[bis(pyridin-2-ylmethyl)amino]-3-[(4-nitropyridin-2-yl)methyl-(pyridin-2-ylmethyl)amino]propan-2-ol Traditional Name: 1-[bis(2-pyridylmethyl)amino]-3-[(4-nitro-2-pyridyl)methyl-(2-pyridylmethyl)amino]propan-2-ol Formula: C27H29N7O3 MolecularWeight: 499.56426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CN(CC2=CC=CC=N2)CC(CN(CC3=CC=CC=N3)CC4=NC=CC(=C4)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=NC(=C1)CN(CC2=CC=CC=N2)CC(CN(CC3=CC=CC=N3)CC4=NC=CC(=C4)[N+](=O)[O-])O

InChI

InChI=1S/C27H29N7O3/c35-27(20-32(16-22-7-1-4-11-28-22)17-23-8-2-5-12-29-23)21-33(18-24-9-3-6-13-30-24)19-25-15-26(34(36)37)10-14-31-25/h1-15,27,35H,16-21H2