(2R)-4-[(3-chlorophenyl)methyl]-2-ethyl-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde

Systemtic Name: (2R)-4-[(3-chlorophenyl)methyl]-2-ethyl-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde Openeye Name: (2R)-4-[(3-chlorophenyl)methyl]-2-ethyl-3-oxo-1,4-benzoxazine-6-carbaldehyde CAS Name: (2R)-4-[(3-chlorophenyl)methyl]-2-ethyl-3-oxo-1,4-benzoxazine-6-carboxaldehyde IUPAC Name: (2R)-4-[(3-chlorophenyl)methyl]-2-ethyl-3-oxo-1,4-benzoxazine-6-carbaldehyde Traditional Name: (2R)-4-(3-chlorobenzyl)-2-ethyl-3-keto-1,4-benzoxazine-6-carbaldehyde Formula: C18H16ClNO3 MolecularWeight: 329.77754

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=C(O1)C=CC(=C2)C=O)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CC[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)C=O)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H16ClNO3/c1-2-16-18(22)20(10-12-4-3-5-14(19)8-12)15-9-13(11-21)6-7-17(15)23-16/h3-9,11,16H,2,10H2,1H3/t16-/m1/s1