N-[[1-[N-cyano-N'-(oxolan-2-ylmethyl)carbamimidoyl]-4-phenyl-piperidin-4-yl]methyl]-2-methoxy-benzamide

Systemtic Name: N-[[1-[N-cyano-N'-(oxolan-2-ylmethyl)carbamimidoyl]-4-phenyl-piperidin-4-yl]methyl]-2-methoxy-benzamide Openeye Name: N-[[1-[N-cyano-N'-(tetrahydrofuran-2-ylmethyl)carbamimidoyl]-4-phenyl-4-piperidyl]methyl]-2-methoxy-benzamide CAS Name: N-[[1-[(cyanoamino)-(2-oxolanylmethylimino)methyl]-4-phenyl-4-piperidinyl]methyl]-2-methoxybenzamide IUPAC Name: N-[[1-[N-cyano-N'-(oxolan-2-ylmethyl)carbamimidoyl]-4-phenylpiperidin-4-yl]methyl]-2-methoxybenzamide Traditional Name: N-[[1-[N-cyano-N'-(tetrahydrofurfuryl)amidino]-4-phenyl-4-piperidyl]methyl]-2-methoxy-benzamide Formula: C27H33N5O3 MolecularWeight: 475.58262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCC2(CCN(CC2)C(=NCC3CCCO3)NC#N)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCC2(CCN(CC2)C(=NCC3CCCO3)NC#N)C4=CC=CC=C4

InChI

InChI=1S/C27H33N5O3/c1-34-24-12-6-5-11-23(24)25(33)30-19-27(21-8-3-2-4-9-21)13-15-32(16-14-27)26(31-20-28)29-18-22-10-7-17-35-22/h2-6,8-9,11-12,22H,7,10,13-19H2,1H3,(H,29,31)(H,30,33)