2-dimethylaminoethyl 6-[3-methyl-1,4-bis(oxidanylidene)naphthalen-2-yl]hexanoate

Systemtic Name: 2-dimethylaminoethyl 6-[3-methyl-1,4-bis(oxidanylidene)naphthalen-2-yl]hexanoate Openeye Name: 2-dimethylaminoethyl 6-(3-methyl-1,4-dioxo-2-naphthyl)hexanoate CAS Name: 6-(3-methyl-1,4-dioxo-2-naphthalenyl)hexanoic acid 2-dimethylaminoethyl ester IUPAC Name: 2-dimethylaminoethyl 6-(3-methyl-1,4-dioxonaphthalen-2-yl)hexanoate Traditional Name: 6-(1,4-diketo-3-methyl-2-naphthyl)hexanoic acid 2-dimethylaminoethyl ester Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=CC=CC=C2C1=O)CCCCCC(=O)OCCN(C)C

Isomeric SMILES

CC1=C(C(=O)C2=CC=CC=C2C1=O)CCCCCC(=O)OCCN(C)C

InChI

InChI=1S/C21H27NO4/c1-15-16(21(25)18-11-8-7-10-17(18)20(15)24)9-5-4-6-12-19(23)26-14-13-22(2)3/h7-8,10-11H,4-6,9,12-14H2,1-3H3