4-azanyl-N'-(3-morpholin-4-ylsulfonylphenyl)carbonyl-quinolin-1-ium-3-carbohydrazide

Systemtic Name: 4-azanyl-N'-(3-morpholin-4-ylsulfonylphenyl)carbonyl-quinolin-1-ium-3-carbohydrazide Openeye Name: 4-amino-N'-(3-morpholinosulfonylbenzoyl)quinolin-1-ium-3-carbohydrazide CAS Name: 4-amino-N'-[[3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]-3-quinolin-1-iumcarbohydrazide IUPAC Name: 4-amino-N'-(3-morpholin-4-ylsulfonylbenzoyl)quinolin-1-ium-3-carbohydrazide Traditional Name: 4-amino-N'-(3-morpholinosulfonylbenzoyl)quinolin-1-ium-3-carbohydrazide Formula: C21H22N5O5S+ MolecularWeight: 456.49488

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)C3=C(C4=CC=CC=C4[NH+]=C3)N

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)C3=C(C4=CC=CC=C4[NH+]=C3)N

InChI

InChI=1S/C21H21N5O5S/c22-19-16-6-1-2-7-18(16)23-13-17(19)21(28)25-24-20(27)14-4-3-5-15(12-14)32(29,30)26-8-10-31-11-9-26/h1-7,12-13H,8-11H2,(H2,22,23)(H,24,27)(H,25,28)/p+1