N-[(2-chlorophenyl)methyl]-3-(diethylamino)-1,4-bis(oxidanylidene)naphthalene-2-sulfonamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-3-(diethylamino)-1,4-bis(oxidanylidene)naphthalene-2-sulfonamide Openeye Name: N-[(2-chlorophenyl)methyl]-3-(diethylamino)-1,4-dioxo-naphthalene-2-sulfonamide CAS Name: N-[(2-chlorophenyl)methyl]-3-(diethylamino)-1,4-dioxo-2-naphthalenesulfonamide IUPAC Name: N-[(2-chlorophenyl)methyl]-3-(diethylamino)-1,4-dioxonaphthalene-2-sulfonamide Traditional Name: N-(2-chlorobenzyl)-3-(diethylamino)-1,4-diketo-naphthalene-2-sulfonamide Formula: C21H21ClN2O4S MolecularWeight: 432.92044

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C(=O)C2=CC=CC=C2C1=O)S(=O)(=O)NCC3=CC=CC=C3Cl

Isomeric SMILES

CCN(CC)C1=C(C(=O)C2=CC=CC=C2C1=O)S(=O)(=O)NCC3=CC=CC=C3Cl

InChI

InChI=1S/C21H21ClN2O4S/c1-3-24(4-2)18-19(25)15-10-6-7-11-16(15)20(26)21(18)29(27,28)23-13-14-9-5-8-12-17(14)22/h5-12,23H,3-4,13H2,1-2H3