N-[4-(4-methylpiperidin-1-yl)phenyl]-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-[4-(4-methylpiperidin-1-yl)phenyl]-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-[4-(4-methyl-1-piperidyl)phenyl]-4-methylsulfonyl-2-nitro-aniline CAS Name: N-[4-(4-methyl-1-piperidinyl)phenyl]-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-[4-(4-methylpiperidin-1-yl)phenyl]-4-methylsulfonyl-2-nitroaniline Traditional Name: (4-mesyl-2-nitro-phenyl)-[4-(4-methylpiperidino)phenyl]amine Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC=C(C=C2)NC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=CC=C(C=C2)NC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O4S/c1-14-9-11-21(12-10-14)16-5-3-15(4-6-16)20-18-8-7-17(27(2,25)26)13-19(18)22(23)24/h3-8,13-14,20H,9-12H2,1-2H3