N-[1-[5-carbamimidoyl-2-[(E)-prop-1-enyl]phenoxy]pentan-2-yl]-1-pyridin-4-yl-piperidine-4-carboxamide

Systemtic Name: N-[1-[5-carbamimidoyl-2-[(E)-prop-1-enyl]phenoxy]pentan-2-yl]-1-pyridin-4-yl-piperidine-4-carboxamide Openeye Name: N-[1-[[5-carbamimidoyl-2-[(E)-prop-1-enyl]phenoxy]methyl]butyl]-1-(4-pyridyl)piperidine-4-carboxamide CAS Name: N-[1-[5-carbamimidoyl-2-[(E)-prop-1-enyl]phenoxy]pentan-2-yl]-1-pyridin-4-yl-4-piperidinecarboxamide IUPAC Name: N-[1-[5-carbamimidoyl-2-[(E)-prop-1-enyl]phenoxy]pentan-2-yl]-1-pyridin-4-ylpiperidine-4-carboxamide Traditional Name: N-[1-[[5-amidino-2-[(E)-prop-1-enyl]phenoxy]methyl]butyl]-1-(4-pyridyl)isonipecotamide Formula: C26H35N5O2 MolecularWeight: 449.5884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(COC1=C(C=CC(=C1)C(=N)N)C=CC)NC(=O)C2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

CCCC(COC1=C(C=CC(=C1)C(=N)N)/C=C/C)NC(=O)C2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C26H35N5O2/c1-3-5-19-7-8-21(25(27)28)17-24(19)33-18-22(6-4-2)30-26(32)20-11-15-31(16-12-20)23-9-13-29-14-10-23/h3,5,7-10,13-14,17,20,22H,4,6,11-12,15-16,18H2,1-2H3,(H3,27,28)(H,30,32)/b5-3+