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

Systemtic Name: N-[[1-(N-azanyl-N'-cyano-carbamimidoyl)-4-phenyl-piperidin-4-yl]methyl]-2-methoxy-benzamide Openeye Name: N-[[1-(N-amino-N'-cyano-carbamimidoyl)-4-phenyl-4-piperidyl]methyl]-2-methoxy-benzamide CAS Name: N-[[1-[cyanoimino(hydrazinyl)methyl]-4-phenyl-4-piperidinyl]methyl]-2-methoxybenzamide IUPAC Name: N-[[1-(N-amino-N'-cyanocarbamimidoyl)-4-phenylpiperidin-4-yl]methyl]-2-methoxybenzamide Traditional Name: N-[[1-(N-amino-N'-cyano-amidino)-4-phenyl-4-piperidyl]methyl]-2-methoxy-benzamide Formula: C22H26N6O2 MolecularWeight: 406.48084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCC2(CCN(CC2)C(=NC#N)NN)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCC2(CCN(CC2)C(=NC#N)NN)C3=CC=CC=C3

InChI

InChI=1S/C22H26N6O2/c1-30-19-10-6-5-9-18(19)20(29)25-15-22(17-7-3-2-4-8-17)11-13-28(14-12-22)21(27-24)26-16-23/h2-10H,11-15,24H2,1H3,(H,25,29)(H,26,27)