3-(2-aminocarbonylhydrazinyl)-3-(4-bromophenyl)propanoic acid; 3-[(4-methylpyridin-2-yl)amino]cyclopentan-1-one

Systemtic Name: 3-(2-aminocarbonylhydrazinyl)-3-(4-bromophenyl)propanoic acid; 3-[(4-methylpyridin-2-yl)amino]cyclopentan-1-one Openeye Name: 3-(4-bromophenyl)-3-(2-carbamoylhydrazino)propanoic acid; 3-[(4-methyl-2-pyridyl)amino]cyclopentanone CAS Name: 3-(4-bromophenyl)-3-(carbamoylhydrazo)propanoic acid; 3-[(4-methyl-2-pyridinyl)amino]-1-cyclopentanone IUPAC Name: 3-(4-bromophenyl)-3-(2-carbamoylhydrazinyl)propanoic acid; 3-[(4-methylpyridin-2-yl)amino]cyclopentan-1-one Traditional Name: 3-(4-bromophenyl)-3-semicarbazido-propionic acid; 3-[(4-methyl-2-pyridyl)amino]cyclopentanone Formula: C21H26BrN5O4 MolecularWeight: 492.36624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)NC2CCC(=O)C2.C1=CC(=CC=C1C(CC(=O)O)NNC(=O)N)Br

Isomeric SMILES

CC1=CC(=NC=C1)NC2CCC(=O)C2.C1=CC(=CC=C1C(CC(=O)O)NNC(=O)N)Br

InChI

InChI=1S/C11H14N2O.C10H12BrN3O3/c1-8-4-5-12-11(6-8)13-9-2-3-10(14)7-9;11-7-3-1-6(2-4-7)8(5-9(15)16)13-14-10(12)17/h4-6,9H,2-3,7H2,1H3,(H,12,13);1-4,8,13H,5H2,(H,15,16)(H3,12,14,17)