N-[3-[(3-carbamimidoylphenyl)methyl]-4-oxidanyl-1-phenyl-butan-2-yl]-4-(4-hydroxyphenyl)benzamide

Systemtic Name: N-[3-[(3-carbamimidoylphenyl)methyl]-4-oxidanyl-1-phenyl-butan-2-yl]-4-(4-hydroxyphenyl)benzamide Openeye Name: N-[1-benzyl-2-[(3-carbamimidoylphenyl)methyl]-3-hydroxy-propyl]-4-(4-hydroxyphenyl)benzamide CAS Name: N-[3-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-1-phenylbutan-2-yl]-4-(4-hydroxyphenyl)benzamide IUPAC Name: N-[3-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-1-phenylbutan-2-yl]-4-(4-hydroxyphenyl)benzamide Traditional Name: N-[2-(3-amidinobenzyl)-1-benzyl-3-hydroxy-propyl]-4-(4-hydroxyphenyl)benzamide Formula: C31H31N3O3 MolecularWeight: 493.59614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(CC2=CC=CC(=C2)C(=N)N)CO)NC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)O

Isomeric SMILES

C1=CC=C(C=C1)CC(C(CC2=CC=CC(=C2)C(=N)N)CO)NC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)O

InChI

InChI=1S/C31H31N3O3/c32-30(33)26-8-4-7-22(17-26)18-27(20-35)29(19-21-5-2-1-3-6-21)34-31(37)25-11-9-23(10-12-25)24-13-15-28(36)16-14-24/h1-17,27,29,35-36H,18-20H2,(H3,32,33)(H,34,37)