N-[(5-methoxy-3,4-dihydro-2H-chromen-3-yl)methyl]-1-(1-pyrimidin-2-ylpiperidin-4-yl)methanamine

Systemtic Name: N-[(5-methoxy-3,4-dihydro-2H-chromen-3-yl)methyl]-1-(1-pyrimidin-2-ylpiperidin-4-yl)methanamine Openeye Name: N-[(5-methoxychroman-3-yl)methyl]-1-(1-pyrimidin-2-yl-4-piperidyl)methanamine CAS Name: N-[(5-methoxy-3,4-dihydro-2H-1-benzopyran-3-yl)methyl]-1-[1-(2-pyrimidinyl)-4-piperidinyl]methanamine IUPAC Name: N-[(5-methoxy-3,4-dihydro-2H-chromen-3-yl)methyl]-1-(1-pyrimidin-2-ylpiperidin-4-yl)methanamine Traditional Name: (5-methoxychroman-3-yl)methyl-[[1-(2-pyrimidyl)-4-piperidyl]methyl]amine Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1CC(CO2)CNCC3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

COC1=CC=CC2=C1CC(CO2)CNCC3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C21H28N4O2/c1-26-19-4-2-5-20-18(19)12-17(15-27-20)14-22-13-16-6-10-25(11-7-16)21-23-8-3-9-24-21/h2-5,8-9,16-17,22H,6-7,10-15H2,1H3