8-[1-[(7-carbamimidoylnaphthalen-2-yl)methyl]-2,5-bis(oxidanylidene)-4-phenyl-imidazolidin-4-yl]octanoic acid

Systemtic Name: 8-[1-[(7-carbamimidoylnaphthalen-2-yl)methyl]-2,5-bis(oxidanylidene)-4-phenyl-imidazolidin-4-yl]octanoic acid Openeye Name: 8-[1-[(7-carbamimidoyl-2-naphthyl)methyl]-2,5-dioxo-4-phenyl-imidazolidin-4-yl]octanoic acid CAS Name: 8-[1-[(7-carbamimidoyl-2-naphthalenyl)methyl]-2,5-dioxo-4-phenyl-4-imidazolidinyl]octanoic acid IUPAC Name: 8-[1-[(7-carbamimidoylnaphthalen-2-yl)methyl]-2,5-dioxo-4-phenylimidazolidin-4-yl]octanoic acid Traditional Name: 8-[1-[(7-amidino-2-naphthyl)methyl]-2,5-diketo-4-phenyl-imidazolidin-4-yl]caprylic acid Formula: C29H32N4O4 MolecularWeight: 500.58878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(C(=O)N(C(=O)N2)CC3=CC4=C(C=C3)C=CC(=C4)C(=N)N)CCCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2(C(=O)N(C(=O)N2)CC3=CC4=C(C=C3)C=CC(=C4)C(=N)N)CCCCCCCC(=O)O

InChI

InChI=1S/C29H32N4O4/c30-26(31)22-15-14-21-13-12-20(17-23(21)18-22)19-33-27(36)29(32-28(33)37,24-9-5-4-6-10-24)16-8-3-1-2-7-11-25(34)35/h4-6,9-10,12-15,17-18H,1-3,7-8,11,16,19H2,(H3,30,31)(H,32,37)(H,34,35)