4-methoxy-N-(2-nitrophenyl)-3-piperidin-1-ylsulfonyl-aniline

Systemtic Name: 4-methoxy-N-(2-nitrophenyl)-3-piperidin-1-ylsulfonyl-aniline Openeye Name: 4-methoxy-N-(2-nitrophenyl)-3-(1-piperidylsulfonyl)aniline CAS Name: 4-methoxy-N-(2-nitrophenyl)-3-(1-piperidinylsulfonyl)aniline IUPAC Name: 4-methoxy-N-(2-nitrophenyl)-3-piperidin-1-ylsulfonylaniline Traditional Name: (4-methoxy-3-piperidinosulfonyl-phenyl)-(2-nitrophenyl)amine Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H21N3O5S/c1-26-17-10-9-14(19-15-7-3-4-8-16(15)21(22)23)13-18(17)27(24,25)20-11-5-2-6-12-20/h3-4,7-10,13,19H,2,5-6,11-12H2,1H3