N-[(Z)-1-(1-adamantyl)ethylideneamino]-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[(Z)-1-(1-adamantyl)ethylideneamino]-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-[(Z)-1-(1-adamantyl)ethylideneamino]-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-[(Z)-1-(1-adamantyl)ethylideneamino]-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[(Z)-1-(1-adamantyl)ethylideneamino]-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-[(Z)-1-(1-adamantyl)ethylideneamino]-4-methyl-3-nitro-benzenesulfonamide Formula: C19H25N3O4S MolecularWeight: 391.4845

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NN=C(C)C23CC4CC(C2)CC(C4)C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N/N=C(/C)\C23CC4CC(C2)CC(C4)C3)[N+](=O)[O-]

InChI

InChI=1S/C19H25N3O4S/c1-12-3-4-17(8-18(12)22(23)24)27(25,26)21-20-13(2)19-9-14-5-15(10-19)7-16(6-14)11-19/h3-4,8,14-16,21H,5-7,9-11H2,1-2H3/b20-13-