N-[(3-methoxyphenyl)methyl]-2-nitro-4-piperidin-1-ylsulfonyl-aniline

Systemtic Name: N-[(3-methoxyphenyl)methyl]-2-nitro-4-piperidin-1-ylsulfonyl-aniline Openeye Name: N-[(3-methoxyphenyl)methyl]-2-nitro-4-(1-piperidylsulfonyl)aniline CAS Name: N-[(3-methoxyphenyl)methyl]-2-nitro-4-(1-piperidinylsulfonyl)aniline IUPAC Name: N-[(3-methoxyphenyl)methyl]-2-nitro-4-piperidin-1-ylsulfonylaniline Traditional Name: m-anisyl-(2-nitro-4-piperidinosulfonyl-phenyl)amine Formula: C19H23N3O5S MolecularWeight: 405.46802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)CNC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O5S/c1-27-16-7-5-6-15(12-16)14-20-18-9-8-17(13-19(18)22(23)24)28(25,26)21-10-3-2-4-11-21/h5-9,12-13,20H,2-4,10-11,14H2,1H3