3-[5-(4-carbamimidoylphenyl)pentanoylamino]-4-naphthalen-1-yl-butanoic acid

Systemtic Name: 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-4-naphthalen-1-yl-butanoic acid Openeye Name: 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-4-(1-naphthyl)butanoic acid CAS Name: 3-[[5-(4-carbamimidoylphenyl)-1-oxopentyl]amino]-4-(1-naphthalenyl)butanoic acid IUPAC Name: 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-4-naphthalen-1-ylbutanoic acid Traditional Name: 3-[5-(4-amidinophenyl)pentanoylamino]-4-(1-naphthyl)butyric acid Formula: C26H29N3O3 MolecularWeight: 431.52676

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CC(CC(=O)O)NC(=O)CCCCC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CC(CC(=O)O)NC(=O)CCCCC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C26H29N3O3/c27-26(28)20-14-12-18(13-15-20)6-1-4-11-24(30)29-22(17-25(31)32)16-21-9-5-8-19-7-2-3-10-23(19)21/h2-3,5,7-10,12-15,22H,1,4,6,11,16-17H2,(H3,27,28)(H,29,30)(H,31,32)