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

Systemtic Name: N,N-diethyl-4-(6'-ethylsulfonylspiro[azepane-4,2'-chromene]-4'-yl)benzamide Openeye Name: N,N-diethyl-4-(6'-ethylsulfonylspiro[azepane-4,2'-chromene]-4'-yl)benzamide CAS Name: N,N-diethyl-4-(6-ethylsulfonyl-4-spiro[1-benzopyran-2,4'-azepane]yl)benzamide IUPAC Name: N,N-diethyl-4-(6'-ethylsulfonylspiro[azepane-4,2'-chromene]-4'-yl)benzamide Traditional Name: 4-(6'-esylspiro[azepane-4,2'-chromene]-4'-yl)-N,N-diethyl-benzamide Formula: C27H34N2O4S MolecularWeight: 482.63486

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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)CC

Isomeric SMILES

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

InChI

InChI=1S/C27H34N2O4S/c1-4-29(5-2)26(30)21-10-8-20(9-11-21)24-19-27(14-7-16-28-17-15-27)33-25-13-12-22(18-23(24)25)34(31,32)6-3/h8-13,18-19,28H,4-7,14-17H2,1-3H3