2-azanylethanoic acid; 4-chloranyl-3-nitro-benzaldehyde; cyclohexanamine

Systemtic Name: 2-azanylethanoic acid; 4-chloranyl-3-nitro-benzaldehyde; cyclohexanamine Openeye Name: 2-aminoacetic acid; 4-chloro-3-nitro-benzaldehyde; cyclohexanamine CAS Name: 2-aminoacetic acid; 4-chloro-3-nitrobenzaldehyde; cyclohexanamine IUPAC Name: 2-aminoacetic acid; 4-chloro-3-nitrobenzaldehyde; cyclohexanamine Traditional Name: 2-aminoacetic acid; 4-chloro-3-nitro-benzaldehyde; cyclohexylamine Formula: C15H22ClN3O5 MolecularWeight: 359.80528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N.C1=CC(=C(C=C1C=O)[N+](=O)[O-])Cl.C(C(=O)O)N

Isomeric SMILES

C1CCC(CC1)N.C1=CC(=C(C=C1C=O)[N+](=O)[O-])Cl.C(C(=O)O)N

InChI

InChI=1S/C7H4ClNO3.C6H13N.C2H5NO2/c8-6-2-1-5(4-10)3-7(6)9(11)12;7-6-4-2-1-3-5-6;3-1-2(4)5/h1-4H;6H,1-5,7H2;1,3H2,(H,4,5)