N-(2-morpholin-4-ylethyl)-5-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-nitro-aniline

Systemtic Name: N-(2-morpholin-4-ylethyl)-5-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-nitro-aniline Openeye Name: N-(2-morpholinoethyl)-5-[4-(2-naphthylsulfonyl)piperazin-1-yl]-2-nitro-aniline CAS Name: N-[2-(4-morpholinyl)ethyl]-5-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-2-nitroaniline IUPAC Name: N-(2-morpholin-4-ylethyl)-5-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-nitroaniline Traditional Name: 2-morpholinoethyl-[5-[4-(2-naphthylsulfonyl)piperazino]-2-nitro-phenyl]amine Formula: C26H31N5O5S MolecularWeight: 525.61984

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])NCCN3CCOCC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])NCCN3CCOCC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H31N5O5S/c32-31(33)26-8-6-23(20-25(26)27-9-10-28-15-17-36-18-16-28)29-11-13-30(14-12-29)37(34,35)24-7-5-21-3-1-2-4-22(21)19-24/h1-8,19-20,27H,9-18H2