[4-[4-(4-fluoranylnaphthalen-1-yl)sulfonylpiperazin-1-yl]-3-nitro-phenyl]-morpholin-4-yl-methanone

Systemtic Name: [4-[4-(4-fluoranylnaphthalen-1-yl)sulfonylpiperazin-1-yl]-3-nitro-phenyl]-morpholin-4-yl-methanone Openeye Name: [4-[4-[(4-fluoro-1-naphthyl)sulfonyl]piperazin-1-yl]-3-nitro-phenyl]-morpholino-methanone CAS Name: [4-[4-[(4-fluoro-1-naphthalenyl)sulfonyl]-1-piperazinyl]-3-nitrophenyl]-(4-morpholinyl)methanone IUPAC Name: [4-[4-(4-fluoronaphthalen-1-yl)sulfonylpiperazin-1-yl]-3-nitrophenyl]-morpholin-4-ylmethanone Traditional Name: [4-[4-[(4-fluoro-1-naphthyl)sulfonyl]piperazino]-3-nitro-phenyl]-morpholino-methanone Formula: C25H25FN4O6S MolecularWeight: 528.552603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(=O)N3CCOCC3)[N+](=O)[O-])S(=O)(=O)C4=CC=C(C5=CC=CC=C54)F

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(=O)N3CCOCC3)[N+](=O)[O-])S(=O)(=O)C4=CC=C(C5=CC=CC=C54)F

InChI

InChI=1S/C25H25FN4O6S/c26-21-6-8-24(20-4-2-1-3-19(20)21)37(34,35)29-11-9-27(10-12-29)22-7-5-18(17-23(22)30(32)33)25(31)28-13-15-36-16-14-28/h1-8,17H,9-16H2