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

Systemtic Name: N5-[1-[(4-methoxy-3-prop-2-enoxy-phenyl)methyl]piperidin-4-yl]-3-methyl-pyridine-2,5-diamine Openeye Name: N5-[1-[(3-allyloxy-4-methoxy-phenyl)methyl]-4-piperidyl]-3-methyl-pyridine-2,5-diamine CAS Name: N5-[1-[(4-methoxy-3-prop-2-enoxyphenyl)methyl]-4-piperidinyl]-3-methylpyridine-2,5-diamine IUPAC Name: 5-N-[1-[(4-methoxy-3-prop-2-enoxyphenyl)methyl]piperidin-4-yl]-3-methylpyridine-2,5-diamine Traditional Name: [1-(3-allyloxy-4-methoxy-benzyl)-4-piperidyl]-(6-amino-5-methyl-3-pyridyl)amine Formula: C22H30N4O2 MolecularWeight: 382.4992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CN=C1N)NC2CCN(CC2)CC3=CC(=C(C=C3)OC)OCC=C

Isomeric SMILES

CC1=CC(=CN=C1N)NC2CCN(CC2)CC3=CC(=C(C=C3)OC)OCC=C

InChI

InChI=1S/C22H30N4O2/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/h4-6,12-14,18,25H,1,7-11,15H2,2-3H3,(H2,23,24)