(2S)-4-(4-hexoxyphenyl)carbonyl-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2S)-4-(4-hexoxyphenyl)carbonyl-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2S)-4-(4-hexoxybenzoyl)-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2S)-4-[(4-hexoxyphenyl)-oxomethyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2S)-4-(4-hexoxybenzoyl)-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2S)-4-(4-hexoxybenzoyl)-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C23H28N2O4 MolecularWeight: 396.47942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)N2CC(OC3=CC=CC=C32)C(=O)NC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)N2C[C@H](OC3=CC=CC=C32)C(=O)NC

InChI

InChI=1S/C23H28N2O4/c1-3-4-5-8-15-28-18-13-11-17(12-14-18)23(27)25-16-21(22(26)24-2)29-20-10-7-6-9-19(20)25/h6-7,9-14,21H,3-5,8,15-16H2,1-2H3,(H,24,26)/t21-/m0/s1