2-[1-[3-[(4-carbamimidoylphenyl)carbonylamino]-2,2-dimethyl-propanoyl]piperidin-4-yl]ethanoic acid

Systemtic Name: 2-[1-[3-[(4-carbamimidoylphenyl)carbonylamino]-2,2-dimethyl-propanoyl]piperidin-4-yl]ethanoic acid Openeye Name: 2-[1-[3-[(4-carbamimidoylbenzoyl)amino]-2,2-dimethyl-propanoyl]-4-piperidyl]acetic acid CAS Name: 2-[1-[3-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-2,2-dimethyl-1-oxopropyl]-4-piperidinyl]acetic acid IUPAC Name: 2-[1-[3-[(4-carbamimidoylbenzoyl)amino]-2,2-dimethylpropanoyl]piperidin-4-yl]acetic acid Traditional Name: 2-[1-[3-[(4-amidinobenzoyl)amino]-2,2-dimethyl-propanoyl]-4-piperidyl]acetic acid Formula: C20H28N4O4 MolecularWeight: 388.46072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1=CC=C(C=C1)C(=N)N)C(=O)N2CCC(CC2)CC(=O)O

Isomeric SMILES

CC(C)(CNC(=O)C1=CC=C(C=C1)C(=N)N)C(=O)N2CCC(CC2)CC(=O)O

InChI

InChI=1S/C20H28N4O4/c1-20(2,19(28)24-9-7-13(8-10-24)11-16(25)26)12-23-18(27)15-5-3-14(4-6-15)17(21)22/h3-6,13H,7-12H2,1-2H3,(H3,21,22)(H,23,27)(H,25,26)