2-[(2-azanyl-4-oxidanylidene-3,1-benzoxazin-6-yl)methyl]-N-[(2,5-dimethylphenyl)methyl]-3-phenyl-propanamide

Systemtic Name: 2-[(2-azanyl-4-oxidanylidene-3,1-benzoxazin-6-yl)methyl]-N-[(2,5-dimethylphenyl)methyl]-3-phenyl-propanamide Openeye Name: 2-[(2-amino-4-oxo-3,1-benzoxazin-6-yl)methyl]-N-[(2,5-dimethylphenyl)methyl]-3-phenyl-propanamide CAS Name: 2-[(2-amino-4-oxo-3,1-benzoxazin-6-yl)methyl]-N-[(2,5-dimethylphenyl)methyl]-3-phenylpropanamide IUPAC Name: 2-[(2-amino-4-oxo-3,1-benzoxazin-6-yl)methyl]-N-[(2,5-dimethylphenyl)methyl]-3-phenylpropanamide Traditional Name: 2-[(2-amino-4-keto-3,1-benzoxazin-6-yl)methyl]-N-(2,5-dimethylbenzyl)-3-phenyl-propionamide Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CNC(=O)C(CC2=CC=CC=C2)CC3=CC4=C(C=C3)N=C(OC4=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)CNC(=O)C(CC2=CC=CC=C2)CC3=CC4=C(C=C3)N=C(OC4=O)N

InChI

InChI=1S/C27H27N3O3/c1-17-8-9-18(2)22(12-17)16-29-25(31)21(13-19-6-4-3-5-7-19)14-20-10-11-24-23(15-20)26(32)33-27(28)30-24/h3-12,15,21H,13-14,16H2,1-2H3,(H2,28,30)(H,29,31)