2-[[1-(2-azanylpropanoyl)piperidin-4-yl]carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[1-(2-azanylpropanoyl)piperidin-4-yl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[1-(2-aminopropanoyl)piperidine-4-carbonyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[[1-(2-amino-1-oxopropyl)-4-piperidinyl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[1-(2-aminopropanoyl)piperidine-4-carbonyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[(1-alanylisonipecotoyl)amino]-3-phenyl-propionic acid Formula: C18H25N3O4 MolecularWeight: 347.4088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)C(=O)NC(CC2=CC=CC=C2)C(=O)O)N

Isomeric SMILES

CC(C(=O)N1CCC(CC1)C(=O)NC(CC2=CC=CC=C2)C(=O)O)N

InChI

InChI=1S/C18H25N3O4/c1-12(19)17(23)21-9-7-14(8-10-21)16(22)20-15(18(24)25)11-13-5-3-2-4-6-13/h2-6,12,14-15H,7-11,19H2,1H3,(H,20,22)(H,24,25)