N5-[1-[(4-chloranyl-3-ethoxy-phenyl)methyl]piperidin-4-yl]-3-methyl-pyridine-2,5-diamine

Systemtic Name: N5-[1-[(4-chloranyl-3-ethoxy-phenyl)methyl]piperidin-4-yl]-3-methyl-pyridine-2,5-diamine Openeye Name: N5-[1-[(4-chloro-3-ethoxy-phenyl)methyl]-4-piperidyl]-3-methyl-pyridine-2,5-diamine CAS Name: N5-[1-[(4-chloro-3-ethoxyphenyl)methyl]-4-piperidinyl]-3-methylpyridine-2,5-diamine IUPAC Name: 5-N-[1-[(4-chloro-3-ethoxyphenyl)methyl]piperidin-4-yl]-3-methylpyridine-2,5-diamine Traditional Name: (6-amino-5-methyl-3-pyridyl)-[1-(4-chloro-3-ethoxy-benzyl)-4-piperidyl]amine Formula: C20H27ClN4O MolecularWeight: 374.90758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CN2CCC(CC2)NC3=CN=C(C(=C3)C)N)Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)CN2CCC(CC2)NC3=CN=C(C(=C3)C)N)Cl

InChI

InChI=1S/C20H27ClN4O/c1-3-26-19-11-15(4-5-18(19)21)13-25-8-6-16(7-9-25)24-17-10-14(2)20(22)23-12-17/h4-5,10-12,16,24H,3,6-9,13H2,1-2H3,(H2,22,23)