N-[(E)-(2-chloranylquinolin-3-yl)methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitro-aniline

Systemtic Name: N-[(E)-(2-chloranylquinolin-3-yl)methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitro-aniline Openeye Name: N-[(E)-(2-chloro-3-quinolyl)methyleneamino]-4-morpholinosulfonyl-2-nitro-aniline CAS Name: N-[(E)-(2-chloro-3-quinolinyl)methylideneamino]-4-(4-morpholinylsulfonyl)-2-nitroaniline IUPAC Name: N-[(E)-(2-chloroquinolin-3-yl)methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitroaniline Traditional Name: [(E)-(2-chloro-3-quinolyl)methyleneamino]-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C20H18ClN5O5S MolecularWeight: 475.90542

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)NN=CC3=CC4=CC=CC=C4N=C3Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)N/N=C/C3=CC4=CC=CC=C4N=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H18ClN5O5S/c21-20-15(11-14-3-1-2-4-17(14)23-20)13-22-24-18-6-5-16(12-19(18)26(27)28)32(29,30)25-7-9-31-10-8-25/h1-6,11-13,24H,7-10H2/b22-13+