2-[[1-(2-azanyl-3-methyl-butanoyl)piperidin-4-yl]carbonylamino]-2-phenyl-ethanoic acid

Systemtic Name: 2-[[1-(2-azanyl-3-methyl-butanoyl)piperidin-4-yl]carbonylamino]-2-phenyl-ethanoic acid Openeye Name: 2-[[1-(2-amino-3-methyl-butanoyl)piperidine-4-carbonyl]amino]-2-phenyl-acetic acid CAS Name: 2-[[[1-(2-amino-3-methyl-1-oxobutyl)-4-piperidinyl]-oxomethyl]amino]-2-phenylacetic acid IUPAC Name: 2-[[1-(2-amino-3-methylbutanoyl)piperidine-4-carbonyl]amino]-2-phenylacetic acid Traditional Name: 2-[[1-(2-amino-3-methyl-butanoyl)isonipecotoyl]amino]-2-phenyl-acetic acid Formula: C19H27N3O4 MolecularWeight: 361.43538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N3O4/c1-12(2)15(20)18(24)22-10-8-14(9-11-22)17(23)21-16(19(25)26)13-6-4-3-5-7-13/h3-7,12,14-16H,8-11,20H2,1-2H3,(H,21,23)(H,25,26)