N-[2-(2-butyl-5-carbamimidoyl-phenoxy)ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxy-benzamide

Systemtic Name: N-[2-(2-butyl-5-carbamimidoyl-phenoxy)ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxy-benzamide Openeye Name: N-[2-(2-butyl-5-carbamimidoyl-phenoxy)ethyl]-4-[(1-ethanimidoyl-4-piperidyl)oxy]benzamide CAS Name: N-[2-(2-butyl-5-carbamimidoylphenoxy)ethyl]-4-[[1-(1-iminoethyl)-4-piperidinyl]oxy]benzamide IUPAC Name: N-[2-(2-butyl-5-carbamimidoylphenoxy)ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide Traditional Name: 4-[(1-acetimidoyl-4-piperidyl)oxy]-N-[2-(5-amidino-2-butyl-phenoxy)ethyl]benzamide Formula: C27H37N5O3 MolecularWeight: 479.61438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C=C1)C(=N)N)OCCNC(=O)C2=CC=C(C=C2)OC3CCN(CC3)C(=N)C

Isomeric SMILES

CCCCC1=C(C=C(C=C1)C(=N)N)OCCNC(=O)C2=CC=C(C=C2)OC3CCN(CC3)C(=N)C

InChI

InChI=1S/C27H37N5O3/c1-3-4-5-20-6-7-22(26(29)30)18-25(20)34-17-14-31-27(33)21-8-10-23(11-9-21)35-24-12-15-32(16-13-24)19(2)28/h6-11,18,24,28H,3-5,12-17H2,1-2H3,(H3,29,30)(H,31,33)