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

Systemtic Name: N5-[1-[(4-methoxy-3-propoxy-phenyl)methyl]piperidin-4-yl]-3-methyl-pyridine-2,5-diamine Openeye Name: N5-[1-[(4-methoxy-3-propoxy-phenyl)methyl]-4-piperidyl]-3-methyl-pyridine-2,5-diamine CAS Name: N5-[1-[(4-methoxy-3-propoxyphenyl)methyl]-4-piperidinyl]-3-methylpyridine-2,5-diamine IUPAC Name: 5-N-[1-[(4-methoxy-3-propoxyphenyl)methyl]piperidin-4-yl]-3-methylpyridine-2,5-diamine Traditional Name: (6-amino-5-methyl-3-pyridyl)-[1-(4-methoxy-3-propoxy-benzyl)-4-piperidyl]amine Formula: C22H32N4O2 MolecularWeight: 384.51508

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)CN2CCC(CC2)NC3=CN=C(C(=C3)C)N)OC

Isomeric SMILES

CCCOC1=C(C=CC(=C1)CN2CCC(CC2)NC3=CN=C(C(=C3)C)N)OC

InChI

InChI=1S/C22H32N4O2/c1-4-11-28-21-13-17(5-6-20(21)27-3)15-26-9-7-18(8-10-26)25-19-12-16(2)22(23)24-14-19/h5-6,12-14,18,25H,4,7-11,15H2,1-3H3,(H2,23,24)