N-(furan-2-ylmethyl)-2-nitro-5-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]aniline

Systemtic Name: N-(furan-2-ylmethyl)-2-nitro-5-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]aniline Openeye Name: N-(2-furylmethyl)-2-nitro-5-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]aniline CAS Name: N-(2-furanylmethyl)-2-nitro-5-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]aniline IUPAC Name: N-(furan-2-ylmethyl)-2-nitro-5-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]aniline Traditional Name: 2-furfuryl-[2-nitro-5-[4-(2-nitrophenyl)sulfonylpiperazino]phenyl]amine Formula: C21H21N5O7S MolecularWeight: 487.48574

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CO3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CO3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O7S/c27-25(28)19-8-7-16(14-18(19)22-15-17-4-3-13-33-17)23-9-11-24(12-10-23)34(31,32)21-6-2-1-5-20(21)26(29)30/h1-8,13-14,22H,9-12,15H2