4-(dimethylaminomethyl)-2-[(2E)-2-(3-methyl-1-oxidanylidene-naphthalen-2-ylidene)hydrazinyl]benzenesulfonic acid

Systemtic Name: 4-(dimethylaminomethyl)-2-[(2E)-2-(3-methyl-1-oxidanylidene-naphthalen-2-ylidene)hydrazinyl]benzenesulfonic acid Openeye Name: 4-(dimethylaminomethyl)-2-[(2E)-2-(3-methyl-1-oxo-2-naphthylidene)hydrazino]benzenesulfonic acid CAS Name: 4-(dimethylaminomethyl)-2-[(2E)-2-(3-methyl-1-oxo-2-naphthalenylidene)hydrazinyl]benzenesulfonic acid IUPAC Name: 4-(dimethylaminomethyl)-2-[(2E)-2-(3-methyl-1-oxonaphthalen-2-ylidene)hydrazinyl]benzenesulfonic acid Traditional Name: 4-(dimethylaminomethyl)-2-[(N'E)-N'-(1-keto-3-methyl-2-naphthylidene)hydrazino]besylic acid Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2C(=O)C1=NNC3=C(C=CC(=C3)CN(C)C)S(=O)(=O)O

Isomeric SMILES

CC\1=CC2=CC=CC=C2C(=O)/C1=N/NC3=C(C=CC(=C3)CN(C)C)S(=O)(=O)O

InChI

InChI=1S/C20H21N3O4S/c1-13-10-15-6-4-5-7-16(15)20(24)19(13)22-21-17-11-14(12-23(2)3)8-9-18(17)28(25,26)27/h4-11,21H,12H2,1-3H3,(H,25,26,27)/b22-19+