[(E)-[azanyl(pyridin-3-yl)methylidene]amino] 4-morpholin-4-ylsulfonylbenzoate

Systemtic Name: [(E)-[azanyl(pyridin-3-yl)methylidene]amino] 4-morpholin-4-ylsulfonylbenzoate Openeye Name: [(E)-[amino(3-pyridyl)methylene]amino] 4-morpholinosulfonylbenzoate CAS Name: 4-(4-morpholinylsulfonyl)benzoic acid [(E)-[amino(3-pyridinyl)methylidene]amino] ester IUPAC Name: [(E)-[amino(pyridin-3-yl)methylidene]amino] 4-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-morpholinosulfonylbenzoic acid [(E)-[amino(3-pyridyl)methylene]amino] ester Formula: C17H18N4O5S MolecularWeight: 390.41362

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)ON=C(C3=CN=CC=C3)N

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)O/N=C(\C3=CN=CC=C3)/N

InChI

InChI=1S/C17H18N4O5S/c18-16(14-2-1-7-19-12-14)20-26-17(22)13-3-5-15(6-4-13)27(23,24)21-8-10-25-11-9-21/h1-7,12H,8-11H2,(H2,18,20)