[2-[(2,3-dimethylcyclohexyl)amino]-2-oxidanylidene-ethyl] 3-azanylnaphthalene-2-carboxylate

Systemtic Name: [2-[(2,3-dimethylcyclohexyl)amino]-2-oxidanylidene-ethyl] 3-azanylnaphthalene-2-carboxylate Openeye Name: [2-[(2,3-dimethylcyclohexyl)amino]-2-oxo-ethyl] 3-aminonaphthalene-2-carboxylate CAS Name: 3-amino-2-naphthalenecarboxylic acid [2-[(2,3-dimethylcyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2,3-dimethylcyclohexyl)amino]-2-oxoethyl] 3-aminonaphthalene-2-carboxylate Traditional Name: 3-aminonaphthalene-2-carboxylic acid [2-[(2,3-dimethylcyclohexyl)amino]-2-keto-ethyl] ester Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)COC(=O)C2=CC3=CC=CC=C3C=C2N

Isomeric SMILES

CC1CCCC(C1C)NC(=O)COC(=O)C2=CC3=CC=CC=C3C=C2N

InChI

InChI=1S/C21H26N2O3/c1-13-6-5-9-19(14(13)2)23-20(24)12-26-21(25)17-10-15-7-3-4-8-16(15)11-18(17)22/h3-4,7-8,10-11,13-14,19H,5-6,9,12,22H2,1-2H3,(H,23,24)