2-[2-(4-tert-butylphenyl)-1-carbamimidoyl-piperidin-4-yl]propanoate hydrochloride

Systemtic Name: 2-[2-(4-tert-butylphenyl)-1-carbamimidoyl-piperidin-4-yl]propanoate hydrochloride Openeye Name: 2-[2-(4-tert-butylphenyl)-1-carbamimidoyl-4-piperidyl]propanoate hydrochloride CAS Name: 2-[2-(4-tert-butylphenyl)-1-carbamimidoyl-4-piperidinyl]propanoate hydrochloride IUPAC Name: 2-[2-(4-tert-butylphenyl)-1-carbamimidoylpiperidin-4-yl]propanoate hydrochloride Traditional Name: 2-[1-amidino-2-(4-tert-butylphenyl)-4-piperidyl]propionate hydrochloride Formula: C19H29ClN3O2- MolecularWeight: 366.90546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCN(C(C1)C2=CC=C(C=C2)C(C)(C)C)C(=N)N)C(=O)[O-].Cl

Isomeric SMILES

CC(C1CCN(C(C1)C2=CC=C(C=C2)C(C)(C)C)C(=N)N)C(=O)[O-].Cl

InChI

InChI=1S/C19H29N3O2.ClH/c1-12(17(23)24)14-9-10-22(18(20)21)16(11-14)13-5-7-15(8-6-13)19(2,3)4;/h5-8,12,14,16H,9-11H2,1-4H3,(H3,20,21)(H,23,24);1H/p-1