2-[4-(3-ethoxynaphthalen-2-yl)carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-(3-ethoxynaphthalen-2-yl)carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-(3-ethoxynaphthalene-2-carbonyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[(3-ethoxy-2-naphthalenyl)-oxomethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(3-ethoxynaphthalene-2-carbonyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(3-ethoxy-2-naphthoyl)piperazino]sulfonylbenzonitrile Formula: C24H23N3O4S MolecularWeight: 449.52212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=CC=CC=C2C=C1C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

CCOC1=CC2=CC=CC=C2C=C1C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C24H23N3O4S/c1-2-31-22-16-19-8-4-3-7-18(19)15-21(22)24(28)26-11-13-27(14-12-26)32(29,30)23-10-6-5-9-20(23)17-25/h3-10,15-16H,2,11-14H2,1H3