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

Systemtic Name: N-[(2-chlorophenyl)methyl]-2-nitro-4-piperidin-1-ylsulfonyl-aniline Openeye Name: N-[(2-chlorophenyl)methyl]-2-nitro-4-(1-piperidylsulfonyl)aniline CAS Name: N-[(2-chlorophenyl)methyl]-2-nitro-4-(1-piperidinylsulfonyl)aniline IUPAC Name: N-[(2-chlorophenyl)methyl]-2-nitro-4-piperidin-1-ylsulfonylaniline Traditional Name: (2-chlorobenzyl)-(2-nitro-4-piperidinosulfonyl-phenyl)amine Formula: C18H20ClN3O4S MolecularWeight: 409.8871

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCC3=CC=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCC3=CC=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H20ClN3O4S/c19-16-7-3-2-6-14(16)13-20-17-9-8-15(12-18(17)22(23)24)27(25,26)21-10-4-1-5-11-21/h2-3,6-9,12,20H,1,4-5,10-11,13H2