2-azanyl-7-[(4-carbamimidoylphenyl)carbonylamino]-2-[3-(4-methoxyphenyl)propanoyl]heptanoic acid

Systemtic Name: 2-azanyl-7-[(4-carbamimidoylphenyl)carbonylamino]-2-[3-(4-methoxyphenyl)propanoyl]heptanoic acid Openeye Name: 2-amino-7-[(4-carbamimidoylbenzoyl)amino]-2-[3-(4-methoxyphenyl)propanoyl]heptanoic acid CAS Name: 2-amino-7-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-2-[3-(4-methoxyphenyl)-1-oxopropyl]heptanoic acid IUPAC Name: 2-amino-7-[(4-carbamimidoylbenzoyl)amino]-2-[3-(4-methoxyphenyl)propanoyl]heptanoic acid Traditional Name: 7-[(4-amidinobenzoyl)amino]-2-amino-2-[3-(4-methoxyphenyl)propanoyl]enanthic acid Formula: C25H32N4O5 MolecularWeight: 468.54538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=O)C(CCCCCNC(=O)C2=CC=C(C=C2)C(=N)N)(C(=O)O)N

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=O)C(CCCCCNC(=O)C2=CC=C(C=C2)C(=N)N)(C(=O)O)N

InChI

InChI=1S/C25H32N4O5/c1-34-20-12-5-17(6-13-20)7-14-21(30)25(28,24(32)33)15-3-2-4-16-29-23(31)19-10-8-18(9-11-19)22(26)27/h5-6,8-13H,2-4,7,14-16,28H2,1H3,(H3,26,27)(H,29,31)(H,32,33)