2-[1-[4-(4-carbamimidoylphenyl)-3-methyl-4-oxidanylidene-butanoyl]piperidin-4-yl]oxyethanoate

Systemtic Name: 2-[1-[4-(4-carbamimidoylphenyl)-3-methyl-4-oxidanylidene-butanoyl]piperidin-4-yl]oxyethanoate Openeye Name: 2-[[1-[4-(4-carbamimidoylphenyl)-3-methyl-4-oxo-butanoyl]-4-piperidyl]oxy]acetate CAS Name: 2-[[1-[4-(4-carbamimidoylphenyl)-3-methyl-1,4-dioxobutyl]-4-piperidinyl]oxy]acetate IUPAC Name: 2-[1-[4-(4-carbamimidoylphenyl)-3-methyl-4-oxobutanoyl]piperidin-4-yl]oxyacetate Traditional Name: 2-[[1-[4-(4-amidinophenyl)-4-keto-3-methyl-butanoyl]-4-piperidyl]oxy]acetate Formula: C19H24N3O5- MolecularWeight: 374.41096

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCC(CC1)OCC(=O)[O-])C(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CC(CC(=O)N1CCC(CC1)OCC(=O)[O-])C(=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C19H25N3O5/c1-12(18(26)13-2-4-14(5-3-13)19(20)21)10-16(23)22-8-6-15(7-9-22)27-11-17(24)25/h2-5,12,15H,6-11H2,1H3,(H3,20,21)(H,24,25)/p-1