4-[3-(morpholin-4-ylmethyl)phenyl]-N-(3-nitrophenyl)pyrimidin-2-amine

Systemtic Name: 4-[3-(morpholin-4-ylmethyl)phenyl]-N-(3-nitrophenyl)pyrimidin-2-amine Openeye Name: 4-[3-(morpholinomethyl)phenyl]-N-(3-nitrophenyl)pyrimidin-2-amine CAS Name: 4-[3-(4-morpholinylmethyl)phenyl]-N-(3-nitrophenyl)-2-pyrimidinamine IUPAC Name: 4-[3-(morpholin-4-ylmethyl)phenyl]-N-(3-nitrophenyl)pyrimidin-2-amine Traditional Name: [4-[3-(morpholinomethyl)phenyl]pyrimidin-2-yl]-(3-nitrophenyl)amine Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC=CC(=C2)C3=NC(=NC=C3)NC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CC2=CC=CC(=C2)C3=NC(=NC=C3)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O3/c27-26(28)19-6-2-5-18(14-19)23-21-22-8-7-20(24-21)17-4-1-3-16(13-17)15-25-9-11-29-12-10-25/h1-8,13-14H,9-12,15H2,(H,22,23,24)