[2-[(2-methyl-4-thiocyanato-phenyl)amino]-2-oxidanylidene-ethyl] 2-naphthalen-1-ylethanoate

Systemtic Name: [2-[(2-methyl-4-thiocyanato-phenyl)amino]-2-oxidanylidene-ethyl] 2-naphthalen-1-ylethanoate Openeye Name: [2-(2-methyl-4-thiocyanato-anilino)-2-oxo-ethyl] 2-(1-naphthyl)acetate CAS Name: 2-(1-naphthalenyl)acetic acid [2-(2-methyl-4-thiocyanatoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-4-thiocyanatoanilino)-2-oxoethyl] 2-naphthalen-1-ylacetate Traditional Name: 2-(1-naphthyl)acetic acid [2-keto-2-(2-methyl-4-thiocyanato-anilino)ethyl] ester Formula: C22H18N2O3S MolecularWeight: 390.45492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SC#N)NC(=O)COC(=O)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC1=C(C=CC(=C1)SC#N)NC(=O)COC(=O)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C22H18N2O3S/c1-15-11-18(28-14-23)9-10-20(15)24-21(25)13-27-22(26)12-17-7-4-6-16-5-2-3-8-19(16)17/h2-11H,12-13H2,1H3,(H,24,25)