4-[(4-azanylidene-3-methyl-cyclohexa-2,5-dien-1-ylidene)-(4-azanyl-3-methyl-phenyl)methyl]-2-methyl-aniline; methyl hydrogen sulfate

Systemtic Name: 4-[(4-azanylidene-3-methyl-cyclohexa-2,5-dien-1-ylidene)-(4-azanyl-3-methyl-phenyl)methyl]-2-methyl-aniline; methyl hydrogen sulfate Openeye Name: 4-[(4-amino-3-methyl-phenyl)-(4-imino-3-methyl-cyclohexa-2,5-dien-1-ylidene)methyl]-2-methyl-aniline; methyl hydrogen sulfate CAS Name: 4-[(4-amino-3-methylphenyl)-(4-imino-3-methyl-1-cyclohexa-2,5-dienylidene)methyl]-2-methylaniline; sulfuric acid methyl ester IUPAC Name: 4-[(4-amino-3-methylphenyl)-(4-imino-3-methylcyclohexa-2,5-dien-1-ylidene)methyl]-2-methylaniline; methyl hydrogen sulfate Traditional Name: [4-[(4-amino-3-methyl-phenyl)-(4-imino-3-methyl-cyclohexa-2,5-dien-1-ylidene)methyl]-2-methyl-phenyl]amine; sulfuric acid methyl ester Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=CC(=C(C=C2)N)C)C3=CC(=C(C=C3)N)C)C=CC1=N.COS(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C2=CC(=C(C=C2)N)C)C3=CC(=C(C=C3)N)C)C=CC1=N.COS(=O)(=O)O

InChI

InChI=1S/C22H23N3.CH4O4S/c1-13-10-16(4-7-19(13)23)22(17-5-8-20(24)14(2)11-17)18-6-9-21(25)15(3)12-18;1-5-6(2,3)4/h4-12,23H,24-25H2,1-3H3;1H3,(H,2,3,4)