3-methoxy-N-[(5-nitrobenzotriazol-1-yl)methyl]aniline

Systemtic Name: 3-methoxy-N-[(5-nitrobenzotriazol-1-yl)methyl]aniline Openeye Name: 3-methoxy-N-[(5-nitrobenzotriazol-1-yl)methyl]aniline CAS Name: 3-methoxy-N-[(5-nitro-1-benzotriazolyl)methyl]aniline IUPAC Name: 3-methoxy-N-[(5-nitrobenzotriazol-1-yl)methyl]aniline Traditional Name: (3-methoxyphenyl)-[(5-nitrobenzotriazol-1-yl)methyl]amine Formula: C14H13N5O3 MolecularWeight: 299.28472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NCN2C3=C(C=C(C=C3)[N+](=O)[O-])N=N2

Isomeric SMILES

COC1=CC=CC(=C1)NCN2C3=C(C=C(C=C3)[N+](=O)[O-])N=N2

InChI

InChI=1S/C14H13N5O3/c1-22-12-4-2-3-10(7-12)15-9-18-14-6-5-11(19(20)21)8-13(14)16-17-18/h2-8,15H,9H2,1H3