N-[(4-methyl-3-nitro-phenyl)methyl]-4,5,6,7-tetrahydro-1-benzofuran-4-amine

Systemtic Name: N-[(4-methyl-3-nitro-phenyl)methyl]-4,5,6,7-tetrahydro-1-benzofuran-4-amine Openeye Name: N-[(4-methyl-3-nitro-phenyl)methyl]-4,5,6,7-tetrahydrobenzofuran-4-amine CAS Name: N-[(4-methyl-3-nitrophenyl)methyl]-4,5,6,7-tetrahydrobenzofuran-4-amine IUPAC Name: N-[(4-methyl-3-nitrophenyl)methyl]-4,5,6,7-tetrahydro-1-benzofuran-4-amine Traditional Name: (4-methyl-3-nitro-benzyl)-(4,5,6,7-tetrahydrobenzofuran-4-yl)amine Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC2CCCC3=C2C=CO3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)CNC2CCCC3=C2C=CO3)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O3/c1-11-5-6-12(9-15(11)18(19)20)10-17-14-3-2-4-16-13(14)7-8-21-16/h5-9,14,17H,2-4,10H2,1H3