2-[1-[[1-(4-carbamimidoylphenyl)piperidin-4-yl]methyl]piperidin-4-ylidene]ethanoic acid

Systemtic Name: 2-[1-[[1-(4-carbamimidoylphenyl)piperidin-4-yl]methyl]piperidin-4-ylidene]ethanoic acid Openeye Name: 2-[1-[[1-(4-carbamimidoylphenyl)-4-piperidyl]methyl]-4-piperidylidene]acetic acid CAS Name: 2-[1-[[1-(4-carbamimidoylphenyl)-4-piperidinyl]methyl]-4-piperidinylidene]acetic acid IUPAC Name: 2-[1-[[1-(4-carbamimidoylphenyl)piperidin-4-yl]methyl]piperidin-4-ylidene]acetic acid Traditional Name: 2-[1-[[1-(4-amidinophenyl)-4-piperidyl]methyl]-4-piperidylidene]acetic acid Formula: C20H28N4O2 MolecularWeight: 356.46192

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2CCC(=CC(=O)O)CC2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1CN(CCC1CN2CCC(=CC(=O)O)CC2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C20H28N4O2/c21-20(22)17-1-3-18(4-2-17)24-11-7-16(8-12-24)14-23-9-5-15(6-10-23)13-19(25)26/h1-4,13,16H,5-12,14H2,(H3,21,22)(H,25,26)