[1-oxidanylidene-1-(1,2,3,4-tetrahydronaphthalen-1-ylamino)propan-2-yl] 2,4-dimethylbenzoate

Systemtic Name: [1-oxidanylidene-1-(1,2,3,4-tetrahydronaphthalen-1-ylamino)propan-2-yl] 2,4-dimethylbenzoate Openeye Name: [1-methyl-2-oxo-2-(tetralin-1-ylamino)ethyl] 2,4-dimethylbenzoate CAS Name: 2,4-dimethylbenzoic acid [1-oxo-1-(1,2,3,4-tetrahydronaphthalen-1-ylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(1,2,3,4-tetrahydronaphthalen-1-ylamino)propan-2-yl] 2,4-dimethylbenzoate Traditional Name: 2,4-dimethylbenzoic acid [2-keto-1-methyl-2-(tetralin-1-ylamino)ethyl] ester Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)OC(C)C(=O)NC2CCCC3=CC=CC=C23)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)OC(C)C(=O)NC2CCCC3=CC=CC=C23)C

InChI

InChI=1S/C22H25NO3/c1-14-11-12-18(15(2)13-14)22(25)26-16(3)21(24)23-20-10-6-8-17-7-4-5-9-19(17)20/h4-5,7,9,11-13,16,20H,6,8,10H2,1-3H3,(H,23,24)