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

Systemtic Name: N5-[1-[[4-methoxy-3-(2-methylpropoxy)phenyl]methyl]piperidin-4-yl]-3-methyl-pyridine-2,5-diamine Openeye Name: N5-[1-[(3-isobutoxy-4-methoxy-phenyl)methyl]-4-piperidyl]-3-methyl-pyridine-2,5-diamine CAS Name: N5-[1-[[4-methoxy-3-(2-methylpropoxy)phenyl]methyl]-4-piperidinyl]-3-methylpyridine-2,5-diamine IUPAC Name: 5-N-[1-[[4-methoxy-3-(2-methylpropoxy)phenyl]methyl]piperidin-4-yl]-3-methylpyridine-2,5-diamine Traditional Name: (6-amino-5-methyl-3-pyridyl)-[1-(3-isobutoxy-4-methoxy-benzyl)-4-piperidyl]amine Formula: C23H34N4O2 MolecularWeight: 398.54166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H34N4O2/c1-16(2)15-29-22-12-18(5-6-21(22)28-4)14-27-9-7-19(8-10-27)26-20-11-17(3)23(24)25-13-20/h5-6,11-13,16,19,26H,7-10,14-15H2,1-4H3,(H2,24,25)