azepan-1-yl-[2-(2-chloranyl-4-nitro-phenyl)sulfanylphenyl]methanone

Systemtic Name: azepan-1-yl-[2-(2-chloranyl-4-nitro-phenyl)sulfanylphenyl]methanone Openeye Name: azepan-1-yl-[2-(2-chloro-4-nitro-phenyl)sulfanylphenyl]methanone CAS Name: 1-azepanyl-[2-[(2-chloro-4-nitrophenyl)thio]phenyl]methanone IUPAC Name: azepan-1-yl-[2-(2-chloro-4-nitrophenyl)sulfanylphenyl]methanone Traditional Name: azepan-1-yl-[2-[(2-chloro-4-nitro-phenyl)thio]phenyl]methanone Formula: C19H19ClN2O3S MolecularWeight: 390.88376

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=CC=C2SC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=CC=C2SC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H19ClN2O3S/c20-16-13-14(22(24)25)9-10-18(16)26-17-8-4-3-7-15(17)19(23)21-11-5-1-2-6-12-21/h3-4,7-10,13H,1-2,5-6,11-12H2