methyl 1-[4-(phenylmethyl)piperidin-1-yl]isoquinoline-4-carboxylate

Systemtic Name: methyl 1-[4-(phenylmethyl)piperidin-1-yl]isoquinoline-4-carboxylate Openeye Name: methyl 1-(4-benzyl-1-piperidyl)isoquinoline-4-carboxylate CAS Name: 1-[4-(phenylmethyl)-1-piperidinyl]-4-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-benzylpiperidin-1-yl)isoquinoline-4-carboxylate Traditional Name: 1-(4-benzylpiperidino)isoquinoline-4-carboxylic acid methyl ester Formula: C23H24N2O2 MolecularWeight: 360.44886

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C2=CC=CC=C21)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CN=C(C2=CC=CC=C21)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H24N2O2/c1-27-23(26)21-16-24-22(20-10-6-5-9-19(20)21)25-13-11-18(12-14-25)15-17-7-3-2-4-8-17/h2-10,16,18H,11-15H2,1H3