N-[(3-chloranyl-4-ethoxy-phenyl)methyl]-1-pyrimidin-2-yl-piperidin-3-amine

Systemtic Name: N-[(3-chloranyl-4-ethoxy-phenyl)methyl]-1-pyrimidin-2-yl-piperidin-3-amine Openeye Name: N-[(3-chloro-4-ethoxy-phenyl)methyl]-1-pyrimidin-2-yl-piperidin-3-amine CAS Name: N-[(3-chloro-4-ethoxyphenyl)methyl]-1-(2-pyrimidinyl)-3-piperidinamine IUPAC Name: N-[(3-chloro-4-ethoxyphenyl)methyl]-1-pyrimidin-2-ylpiperidin-3-amine Traditional Name: (3-chloro-4-ethoxy-benzyl)-[1-(2-pyrimidyl)-3-piperidyl]amine Formula: C18H23ClN4O MolecularWeight: 346.85442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC2CCCN(C2)C3=NC=CC=N3)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC2CCCN(C2)C3=NC=CC=N3)Cl

InChI

InChI=1S/C18H23ClN4O/c1-2-24-17-7-6-14(11-16(17)19)12-22-15-5-3-10-23(13-15)18-20-8-4-9-21-18/h4,6-9,11,15,22H,2-3,5,10,12-13H2,1H3