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

Systemtic Name: ethyl 2-[1-[(2S)-2-[(4-carbamimidoylphenyl)carbonylamino]propanoyl]piperidin-4-yl]oxyethanoate Openeye Name: ethyl 2-[[1-[(2S)-2-[(4-carbamimidoylbenzoyl)amino]propanoyl]-4-piperidyl]oxy]acetate CAS Name: 2-[[1-[(2S)-2-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-1-oxopropyl]-4-piperidinyl]oxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-[(2S)-2-[(4-carbamimidoylbenzoyl)amino]propanoyl]piperidin-4-yl]oxyacetate Traditional Name: 2-[[1-[(2S)-2-[(4-amidinobenzoyl)amino]propanoyl]-4-piperidyl]oxy]acetic acid ethyl ester Formula: C20H28N4O5 MolecularWeight: 404.46012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1CCN(CC1)C(=O)C(C)NC(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CCOC(=O)COC1CCN(CC1)C(=O)[C@H](C)NC(=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C20H28N4O5/c1-3-28-17(25)12-29-16-8-10-24(11-9-16)20(27)13(2)23-19(26)15-6-4-14(5-7-15)18(21)22/h4-7,13,16H,3,8-12H2,1-2H3,(H3,21,22)(H,23,26)/t13-/m0/s1