ethyl 2-[1-[2-[(4-carbamimidoylphenyl)carbonylamino]butanoyl]piperidin-4-yl]oxyethanoate

Systemtic Name: ethyl 2-[1-[2-[(4-carbamimidoylphenyl)carbonylamino]butanoyl]piperidin-4-yl]oxyethanoate Openeye Name: ethyl 2-[[1-[2-[(4-carbamimidoylbenzoyl)amino]butanoyl]-4-piperidyl]oxy]acetate CAS Name: 2-[[1-[2-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-1-oxobutyl]-4-piperidinyl]oxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-[2-[(4-carbamimidoylbenzoyl)amino]butanoyl]piperidin-4-yl]oxyacetate Traditional Name: 2-[[1-[2-[(4-amidinobenzoyl)amino]butanoyl]-4-piperidyl]oxy]acetic acid ethyl ester Formula: C21H30N4O5 MolecularWeight: 418.4867

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCC(CC1)OCC(=O)OCC)NC(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CCC(C(=O)N1CCC(CC1)OCC(=O)OCC)NC(=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C21H30N4O5/c1-3-17(24-20(27)15-7-5-14(6-8-15)19(22)23)21(28)25-11-9-16(10-12-25)30-13-18(26)29-4-2/h5-8,16-17H,3-4,9-13H2,1-2H3,(H3,22,23)(H,24,27)