4-carbamimidoyl-N-[3-(4-hexoxyphenyl)-1-oxidanylidene-1-(4-oxidanylpiperidin-1-yl)propan-2-yl]benzamide

Systemtic Name: 4-carbamimidoyl-N-[3-(4-hexoxyphenyl)-1-oxidanylidene-1-(4-oxidanylpiperidin-1-yl)propan-2-yl]benzamide Openeye Name: 4-carbamimidoyl-N-[1-[(4-hexoxyphenyl)methyl]-2-(4-hydroxy-1-piperidyl)-2-oxo-ethyl]benzamide CAS Name: 4-carbamimidoyl-N-[3-(4-hexoxyphenyl)-1-(4-hydroxy-1-piperidinyl)-1-oxopropan-2-yl]benzamide IUPAC Name: 4-carbamimidoyl-N-[3-(4-hexoxyphenyl)-1-(4-hydroxypiperidin-1-yl)-1-oxopropan-2-yl]benzamide Traditional Name: 4-amidino-N-[1-(4-hexoxybenzyl)-2-(4-hydroxypiperidino)-2-keto-ethyl]benzamide Formula: C28H38N4O4 MolecularWeight: 494.62572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)CC(C(=O)N2CCC(CC2)O)NC(=O)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)CC(C(=O)N2CCC(CC2)O)NC(=O)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C28H38N4O4/c1-2-3-4-5-18-36-24-12-6-20(7-13-24)19-25(28(35)32-16-14-23(33)15-17-32)31-27(34)22-10-8-21(9-11-22)26(29)30/h6-13,23,25,33H,2-5,14-19H2,1H3,(H3,29,30)(H,31,34)