[1-(2,3-dihydro-1H-inden-5-ylamino)-1-oxidanylidene-propan-2-yl] 2-azanyl-3-methyl-benzoate

Systemtic Name: [1-(2,3-dihydro-1H-inden-5-ylamino)-1-oxidanylidene-propan-2-yl] 2-azanyl-3-methyl-benzoate Openeye Name: [2-(indan-5-ylamino)-1-methyl-2-oxo-ethyl] 2-amino-3-methyl-benzoate CAS Name: 2-amino-3-methylbenzoic acid [1-(2,3-dihydro-1H-inden-5-ylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,3-dihydro-1H-inden-5-ylamino)-1-oxopropan-2-yl] 2-amino-3-methylbenzoate Traditional Name: 2-amino-3-methyl-benzoic acid [2-(indan-5-ylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1N)C(=O)OC(C)C(=O)NC2=CC3=C(CCC3)C=C2

Isomeric SMILES

CC1=CC=CC(=C1N)C(=O)OC(C)C(=O)NC2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C20H22N2O3/c1-12-5-3-8-17(18(12)21)20(24)25-13(2)19(23)22-16-10-9-14-6-4-7-15(14)11-16/h3,5,8-11,13H,4,6-7,21H2,1-2H3,(H,22,23)