N-[3-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-(4-chloro-3-morpholinosulfonyl-anilino)-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[4-chloro-3-(4-morpholinylsulfonyl)anilino]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-(4-chloro-3-morpholin-4-ylsulfonylanilino)-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-(4-chloro-3-morpholinosulfonyl-anilino)-3-keto-propyl]-4-nitro-benzamide Formula: C20H21ClN4O7S MolecularWeight: 496.92134

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H21ClN4O7S/c21-17-6-3-15(13-18(17)33(30,31)24-9-11-32-12-10-24)23-19(26)7-8-22-20(27)14-1-4-16(5-2-14)25(28)29/h1-6,13H,7-12H2,(H,22,27)(H,23,26)