2-[[[4-[(4-carbamimidoylnaphthalen-1-yl)amino]-4-oxidanylidene-butanoyl]amino]-phenyl-methyl]butanoate

Systemtic Name: 2-[[[4-[(4-carbamimidoylnaphthalen-1-yl)amino]-4-oxidanylidene-butanoyl]amino]-phenyl-methyl]butanoate Openeye Name: 2-[[[4-[(4-carbamimidoyl-1-naphthyl)amino]-4-oxo-butanoyl]amino]-phenyl-methyl]butanoate CAS Name: 2-[[[4-[(4-carbamimidoyl-1-naphthalenyl)amino]-1,4-dioxobutyl]amino]-phenylmethyl]butanoate IUPAC Name: 2-[[[4-[(4-carbamimidoylnaphthalen-1-yl)amino]-4-oxobutanoyl]amino]-phenylmethyl]butanoate Traditional Name: 2-[[[4-[(4-amidino-1-naphthyl)amino]-4-keto-butanoyl]amino]-phenyl-methyl]butyrate Formula: C26H27N4O4- MolecularWeight: 459.51698

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=CC=CC=C1)NC(=O)CCC(=O)NC2=CC=C(C3=CC=CC=C32)C(=N)N)C(=O)[O-]

Isomeric SMILES

CCC(C(C1=CC=CC=C1)NC(=O)CCC(=O)NC2=CC=C(C3=CC=CC=C32)C(=N)N)C(=O)[O-]

InChI

InChI=1S/C26H28N4O4/c1-2-17(26(33)34)24(16-8-4-3-5-9-16)30-23(32)15-14-22(31)29-21-13-12-20(25(27)28)18-10-6-7-11-19(18)21/h3-13,17,24H,2,14-15H2,1H3,(H3,27,28)(H,29,31)(H,30,32)(H,33,34)/p-1