N-[1-[5-carbamimidoyl-2-(3-oxidanylidenebutyl)phenoxy]-4-oxidanylidene-pentan-2-yl]-4-(1-ethanimidoylpiperidin-4-yl)oxy-benzamide

Systemtic Name: N-[1-[5-carbamimidoyl-2-(3-oxidanylidenebutyl)phenoxy]-4-oxidanylidene-pentan-2-yl]-4-(1-ethanimidoylpiperidin-4-yl)oxy-benzamide Openeye Name: N-[1-[[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]methyl]-3-oxo-butyl]-4-[(1-ethanimidoyl-4-piperidyl)oxy]benzamide CAS Name: N-[1-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]-4-oxopentan-2-yl]-4-[[1-(1-iminoethyl)-4-piperidinyl]oxy]benzamide IUPAC Name: N-[1-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]-4-oxopentan-2-yl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide Traditional Name: 4-[(1-acetimidoyl-4-piperidyl)oxy]-N-[1-[[5-amidino-2-(3-ketobutyl)phenoxy]methyl]-3-keto-butyl]benzamide Formula: C30H39N5O5 MolecularWeight: 549.66116

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=C(C=C(C=C1)C(=N)N)OCC(CC(=O)C)NC(=O)C2=CC=C(C=C2)OC3CCN(CC3)C(=N)C

Isomeric SMILES

CC(=O)CCC1=C(C=C(C=C1)C(=N)N)OCC(CC(=O)C)NC(=O)C2=CC=C(C=C2)OC3CCN(CC3)C(=N)C

InChI

InChI=1S/C30H39N5O5/c1-19(36)4-5-22-6-7-24(29(32)33)17-28(22)39-18-25(16-20(2)37)34-30(38)23-8-10-26(11-9-23)40-27-12-14-35(15-13-27)21(3)31/h6-11,17,25,27,31H,4-5,12-16,18H2,1-3H3,(H3,32,33)(H,34,38)