N-[2-(3-carbamimidoylphenoxy)ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxy-N-(phenylmethyl)benzamide

Systemtic Name: N-[2-(3-carbamimidoylphenoxy)ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxy-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-[2-(3-carbamimidoylphenoxy)ethyl]-4-[(1-ethanimidoyl-4-piperidyl)oxy]benzamide CAS Name: N-[2-(3-carbamimidoylphenoxy)ethyl]-4-[[1-(1-iminoethyl)-4-piperidinyl]oxy]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-[2-(3-carbamimidoylphenoxy)ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide Traditional Name: 4-[(1-acetimidoyl-4-piperidyl)oxy]-N-[2-(3-amidinophenoxy)ethyl]-N-benzyl-benzamide Formula: C30H35N5O3 MolecularWeight: 513.6306

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)N1CCC(CC1)OC2=CC=C(C=C2)C(=O)N(CCOC3=CC=CC(=C3)C(=N)N)CC4=CC=CC=C4

Isomeric SMILES

CC(=N)N1CCC(CC1)OC2=CC=C(C=C2)C(=O)N(CCOC3=CC=CC(=C3)C(=N)N)CC4=CC=CC=C4

InChI

InChI=1S/C30H35N5O3/c1-22(31)34-16-14-27(15-17-34)38-26-12-10-24(11-13-26)30(36)35(21-23-6-3-2-4-7-23)18-19-37-28-9-5-8-25(20-28)29(32)33/h2-13,20,27,31H,14-19,21H2,1H3,(H3,32,33)