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2-[1-carbamimidoyl-2-(2,3,4-trimethylphenyl)piperidin-4-yl]propanoic acid

2-[1-carbamimidoyl-2-(2,3,4-trimethylphenyl)piperidin-4-yl]propanoic acid

Systemtic Name:2-[1-carbamimidoyl-2-(2,3,4-trimethylphenyl)piperidin-4-yl]propanoic acid
Openeye Name:2-[1-carbamimidoyl-2-(2,3,4-trimethylphenyl)-4-piperidyl]propanoic acid
CAS Name:2-[1-carbamimidoyl-2-(2,3,4-trimethylphenyl)-4-piperidinyl]propanoic acid
IUPAC Name:2-[1-carbamimidoyl-2-(2,3,4-trimethylphenyl)piperidin-4-yl]propanoic acid
Traditional Name:2-[1-amidino-2-(2,3,4-trimethylphenyl)-4-piperidyl]propionic acid
Formula: C18H27N3O2
MolecularWeight: 317.42588
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C2CC(CCN2C(=N)N)C(C)C(=O)O)C)C


Isomeric SMILES

CC1=C(C(=C(C=C1)C2CC(CCN2C(=N)N)C(C)C(=O)O)C)C


InChI

InChI=1S/C18H27N3O2/c1-10-5-6-15(12(3)11(10)2)16-9-14(13(4)17(22)23)7-8-21(16)18(19)20/h5-6,13-14,16H,7-9H2,1-4H3,(H3,19,20)(H,22,23)


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