5-[2-[4-(4-carbamimidoylphenyl)-3-methyl-2-oxidanylidene-1,3-oxazinan-6-yl]ethanoylamino]-5-phenyl-pentanoic acid

Systemtic Name: 5-[2-[4-(4-carbamimidoylphenyl)-3-methyl-2-oxidanylidene-1,3-oxazinan-6-yl]ethanoylamino]-5-phenyl-pentanoic acid Openeye Name: 5-[[2-[4-(4-carbamimidoylphenyl)-3-methyl-2-oxo-1,3-oxazinan-6-yl]acetyl]amino]-5-phenyl-pentanoic acid CAS Name: 5-[[2-[4-(4-carbamimidoylphenyl)-3-methyl-2-oxo-1,3-oxazinan-6-yl]-1-oxoethyl]amino]-5-phenylpentanoic acid IUPAC Name: 5-[[2-[4-(4-carbamimidoylphenyl)-3-methyl-2-oxo-1,3-oxazinan-6-yl]acetyl]amino]-5-phenylpentanoic acid Traditional Name: 5-[[2-[4-(4-amidinophenyl)-2-keto-3-methyl-1,3-oxazinan-6-yl]acetyl]amino]-5-phenyl-valeric acid Formula: C25H30N4O5 MolecularWeight: 466.5295

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CC(OC1=O)CC(=O)NC(CCCC(=O)O)C2=CC=CC=C2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CN1C(CC(OC1=O)CC(=O)NC(CCCC(=O)O)C2=CC=CC=C2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C25H30N4O5/c1-29-21(17-10-12-18(13-11-17)24(26)27)14-19(34-25(29)33)15-22(30)28-20(8-5-9-23(31)32)16-6-3-2-4-7-16/h2-4,6-7,10-13,19-21H,5,8-9,14-15H2,1H3,(H3,26,27)(H,28,30)(H,31,32)