2-(5-chloranyl-1,3-benzoxazol-2-yl)-4-nitro-N-propyl-aniline

Systemtic Name: 2-(5-chloranyl-1,3-benzoxazol-2-yl)-4-nitro-N-propyl-aniline Openeye Name: 2-(5-chloro-1,3-benzoxazol-2-yl)-4-nitro-N-propyl-aniline CAS Name: 2-(5-chloro-1,3-benzoxazol-2-yl)-4-nitro-N-propylaniline IUPAC Name: 2-(5-chloro-1,3-benzoxazol-2-yl)-4-nitro-N-propylaniline Traditional Name: [2-(5-chloro-1,3-benzoxazol-2-yl)-4-nitro-phenyl]-propyl-amine Formula: C16H14ClN3O3 MolecularWeight: 331.75366

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C=C1)[N+](=O)[O-])C2=NC3=C(O2)C=CC(=C3)Cl

Isomeric SMILES

CCCNC1=C(C=C(C=C1)[N+](=O)[O-])C2=NC3=C(O2)C=CC(=C3)Cl

InChI

InChI=1S/C16H14ClN3O3/c1-2-7-18-13-5-4-11(20(21)22)9-12(13)16-19-14-8-10(17)3-6-15(14)23-16/h3-6,8-9,18H,2,7H2,1H3