N,N-diethyl-4-(6'-methylsulfonylspiro[azepane-4,2'-chromene]-4'-yl)benzamide

Systemtic Name: N,N-diethyl-4-(6'-methylsulfonylspiro[azepane-4,2'-chromene]-4'-yl)benzamide Openeye Name: N,N-diethyl-4-(6'-methylsulfonylspiro[azepane-4,2'-chromene]-4'-yl)benzamide CAS Name: N,N-diethyl-4-(6-methylsulfonyl-4-spiro[1-benzopyran-2,4'-azepane]yl)benzamide IUPAC Name: N,N-diethyl-4-(6'-methylsulfonylspiro[azepane-4,2'-chromene]-4'-yl)benzamide Traditional Name: N,N-diethyl-4-(6'-mesylspiro[azepane-4,2'-chromene]-4'-yl)benzamide Formula: C26H32N2O4S MolecularWeight: 468.60828

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C2=CC3(CCCNCC3)OC4=C2C=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C2=CC3(CCCNCC3)OC4=C2C=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C26H32N2O4S/c1-4-28(5-2)25(29)20-9-7-19(8-10-20)23-18-26(13-6-15-27-16-14-26)32-24-12-11-21(17-22(23)24)33(3,30)31/h7-12,17-18,27H,4-6,13-16H2,1-3H3