(2R)-6-[(1S)-1-azanylethyl]-4-[(4-tert-butylphenyl)methyl]-2-methyl-1,4-benzoxazin-3-one

Systemtic Name: (2R)-6-[(1S)-1-azanylethyl]-4-[(4-tert-butylphenyl)methyl]-2-methyl-1,4-benzoxazin-3-one Openeye Name: (2R)-6-[(1S)-1-aminoethyl]-4-[(4-tert-butylphenyl)methyl]-2-methyl-1,4-benzoxazin-3-one CAS Name: (2R)-6-[(1S)-1-aminoethyl]-4-[(4-tert-butylphenyl)methyl]-2-methyl-1,4-benzoxazin-3-one IUPAC Name: (2R)-6-[(1S)-1-aminoethyl]-4-[(4-tert-butylphenyl)methyl]-2-methyl-1,4-benzoxazin-3-one Traditional Name: (2R)-6-[(1S)-1-aminoethyl]-4-(4-tert-butylbenzyl)-2-methyl-1,4-benzoxazin-3-one Formula: C22H28N2O2 MolecularWeight: 352.46992

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)C(C)N)CC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O2/c1-14(23)17-8-11-20-19(12-17)24(21(25)15(2)26-20)13-16-6-9-18(10-7-16)22(3,4)5/h6-12,14-15H,13,23H2,1-5H3/t14-,15+/m0/s1