2-[1-carbamimidoyl-2-(2,3-dihydro-1H-inden-5-yl)piperidin-4-yl]propanoic acid

Systemtic Name: 2-[1-carbamimidoyl-2-(2,3-dihydro-1H-inden-5-yl)piperidin-4-yl]propanoic acid Openeye Name: 2-(1-carbamimidoyl-2-indan-5-yl-4-piperidyl)propanoic acid CAS Name: 2-[1-carbamimidoyl-2-(2,3-dihydro-1H-inden-5-yl)-4-piperidinyl]propanoic acid IUPAC Name: 2-[1-carbamimidoyl-2-(2,3-dihydro-1H-inden-5-yl)piperidin-4-yl]propanoic acid Traditional Name: 2-(1-amidino-2-indan-5-yl-4-piperidyl)propionic acid Formula: C18H25N3O2 MolecularWeight: 315.41

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCN(C(C1)C2=CC3=C(CCC3)C=C2)C(=N)N)C(=O)O

Isomeric SMILES

CC(C1CCN(C(C1)C2=CC3=C(CCC3)C=C2)C(=N)N)C(=O)O

InChI

InChI=1S/C18H25N3O2/c1-11(17(22)23)13-7-8-21(18(19)20)16(10-13)15-6-5-12-3-2-4-14(12)9-15/h5-6,9,11,13,16H,2-4,7-8,10H2,1H3,(H3,19,20)(H,22,23)