[6-[(2,6-dimethylphenyl)carbamoylamino]-2-methyl-chromen-2-yl]methyl benzoate

Systemtic Name: [6-[(2,6-dimethylphenyl)carbamoylamino]-2-methyl-chromen-2-yl]methyl benzoate Openeye Name: [6-[(2,6-dimethylphenyl)carbamoylamino]-2-methyl-chromen-2-yl]methyl benzoate CAS Name: benzoic acid [6-[[(2,6-dimethylanilino)-oxomethyl]amino]-2-methyl-1-benzopyran-2-yl]methyl ester IUPAC Name: [6-[(2,6-dimethylphenyl)carbamoylamino]-2-methylchromen-2-yl]methyl benzoate Traditional Name: benzoic acid [6-[(2,6-dimethylphenyl)carbamoylamino]-2-methyl-chromen-2-yl]methyl ester Formula: C27H26N2O4 MolecularWeight: 442.50634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)NC2=CC3=C(C=C2)OC(C=C3)(C)COC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)NC2=CC3=C(C=C2)OC(C=C3)(C)COC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H26N2O4/c1-18-8-7-9-19(2)24(18)29-26(31)28-22-12-13-23-21(16-22)14-15-27(3,33-23)17-32-25(30)20-10-5-4-6-11-20/h4-16H,17H2,1-3H3,(H2,28,29,31)