3-acetamido-2-[(1-nitroacridin-9-yl)amino]butanoic acid

Systemtic Name: 3-acetamido-2-[(1-nitroacridin-9-yl)amino]butanoic acid Openeye Name: 3-acetamido-2-[(1-nitroacridin-9-yl)amino]butanoic acid CAS Name: 3-acetamido-2-[(1-nitro-9-acridinyl)amino]butanoic acid IUPAC Name: 3-acetamido-2-[(1-nitroacridin-9-yl)amino]butanoic acid Traditional Name: 3-acetamido-2-[(1-nitroacridin-9-yl)amino]butyric acid Formula: C19H18N4O5 MolecularWeight: 382.37002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC1=C2C(=NC3=CC=CC=C31)C=CC=C2[N+](=O)[O-])NC(=O)C

Isomeric SMILES

CC(C(C(=O)O)NC1=C2C(=NC3=CC=CC=C31)C=CC=C2[N+](=O)[O-])NC(=O)C

InChI

InChI=1S/C19H18N4O5/c1-10(20-11(2)24)17(19(25)26)22-18-12-6-3-4-7-13(12)21-14-8-5-9-15(16(14)18)23(27)28/h3-10,17H,1-2H3,(H,20,24)(H,21,22)(H,25,26)