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

Systemtic Name: 2-(4-methyl-1,3-benzoxazol-2-yl)-4-nitro-N-propyl-aniline Openeye Name: 2-(4-methyl-1,3-benzoxazol-2-yl)-4-nitro-N-propyl-aniline CAS Name: 2-(4-methyl-1,3-benzoxazol-2-yl)-4-nitro-N-propylaniline IUPAC Name: 2-(4-methyl-1,3-benzoxazol-2-yl)-4-nitro-N-propylaniline Traditional Name: [2-(4-methyl-1,3-benzoxazol-2-yl)-4-nitro-phenyl]-propyl-amine Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C=C1)[N+](=O)[O-])C2=NC3=C(C=CC=C3O2)C

Isomeric SMILES

CCCNC1=C(C=C(C=C1)[N+](=O)[O-])C2=NC3=C(C=CC=C3O2)C

InChI

InChI=1S/C17H17N3O3/c1-3-9-18-14-8-7-12(20(21)22)10-13(14)17-19-16-11(2)5-4-6-15(16)23-17/h4-8,10,18H,3,9H2,1-2H3