N-[(Z)-4-(4-methoxyphenyl)butan-2-ylideneamino]-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[(Z)-4-(4-methoxyphenyl)butan-2-ylideneamino]-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-[(Z)-[3-(4-methoxyphenyl)-1-methyl-propylidene]amino]-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-[(Z)-4-(4-methoxyphenyl)butan-2-ylideneamino]-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[(Z)-4-(4-methoxyphenyl)butan-2-ylideneamino]-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-[(Z)-[3-(4-methoxyphenyl)-1-methyl-propylidene]amino]-4-methyl-3-nitro-benzenesulfonamide Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NN=C(C)CCC2=CC=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N/N=C(/C)\CCC2=CC=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O5S/c1-13-4-11-17(12-18(13)21(22)23)27(24,25)20-19-14(2)5-6-15-7-9-16(26-3)10-8-15/h4,7-12,20H,5-6H2,1-3H3/b19-14-