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

Systemtic Name: 2-[1-carbamimidoyl-2-(2-phenylphenyl)piperidin-4-yl]propanoate hydrochloride Openeye Name: 2-[1-carbamimidoyl-2-(2-phenylphenyl)-4-piperidyl]propanoate hydrochloride CAS Name: 2-[1-carbamimidoyl-2-(2-phenylphenyl)-4-piperidinyl]propanoate hydrochloride IUPAC Name: 2-[1-carbamimidoyl-2-(2-phenylphenyl)piperidin-4-yl]propanoate hydrochloride Traditional Name: 2-[1-amidino-2-(2-phenylphenyl)-4-piperidyl]propionate hydrochloride Formula: C21H25ClN3O2- MolecularWeight: 386.8951

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCN(C(C1)C2=CC=CC=C2C3=CC=CC=C3)C(=N)N)C(=O)[O-].Cl

Isomeric SMILES

CC(C1CCN(C(C1)C2=CC=CC=C2C3=CC=CC=C3)C(=N)N)C(=O)[O-].Cl

InChI

InChI=1S/C21H25N3O2.ClH/c1-14(20(25)26)16-11-12-24(21(22)23)19(13-16)18-10-6-5-9-17(18)15-7-3-2-4-8-15;/h2-10,14,16,19H,11-13H2,1H3,(H3,22,23)(H,25,26);1H/p-1