2-diethylaminoethyl 4-[2-(5-methyl-4-oxidanylidene-2-propan-2-yl-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzoate chloride

Systemtic Name: 2-diethylaminoethyl 4-[2-(5-methyl-4-oxidanylidene-2-propan-2-yl-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzoate chloride Openeye Name: 2-diethylaminoethyl 4-[2-(2-isopropyl-5-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)hydrazino]benzoate chloride CAS Name: 4-[2-(5-methyl-4-oxo-2-propan-2-yl-1-cyclohexa-2,5-dienylidene)hydrazinyl]benzoic acid 2-diethylaminoethyl ester chloride IUPAC Name: 2-diethylaminoethyl 4-[2-(5-methyl-4-oxo-2-propan-2-ylcyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzoate chloride Traditional Name: 4-[N'-(2-isopropyl-4-keto-5-methyl-cyclohexa-2,5-dien-1-ylidene)hydrazino]benzoic acid 2-diethylaminoethyl ester chloride Formula: C23H31ClN3O3- MolecularWeight: 432.96354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NN=C2C=C(C(=O)C=C2C(C)C)C.[Cl-]

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NN=C2C=C(C(=O)C=C2C(C)C)C.[Cl-]

InChI

InChI=1S/C23H31N3O3.ClH/c1-6-26(7-2)12-13-29-23(28)18-8-10-19(11-9-18)24-25-21-14-17(5)22(27)15-20(21)16(3)4;/h8-11,14-16,24H,6-7,12-13H2,1-5H3;1H/p-1