(2S)-2-(6-chloranylbenzotriazol-1-yl)oxy-N-(3-nitrophenyl)propanamide

Systemtic Name: (2S)-2-(6-chloranylbenzotriazol-1-yl)oxy-N-(3-nitrophenyl)propanamide Openeye Name: (2S)-2-(6-chlorobenzotriazol-1-yl)oxy-N-(3-nitrophenyl)propanamide CAS Name: (2S)-2-[(6-chloro-1-benzotriazolyl)oxy]-N-(3-nitrophenyl)propanamide IUPAC Name: (2S)-2-(6-chlorobenzotriazol-1-yl)oxy-N-(3-nitrophenyl)propanamide Traditional Name: (2S)-2-(6-chlorobenzotriazol-1-yl)oxy-N-(3-nitrophenyl)propionamide Formula: C15H12ClN5O4 MolecularWeight: 361.73988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])ON2C3=C(C=CC(=C3)Cl)N=N2

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])ON2C3=C(C=CC(=C3)Cl)N=N2

InChI

InChI=1S/C15H12ClN5O4/c1-9(15(22)17-11-3-2-4-12(8-11)21(23)24)25-20-14-7-10(16)5-6-13(14)18-19-20/h2-9H,1H3,(H,17,22)/t9-/m0/s1