(2R)-6-[(1S)-1-azanylpropyl]-2-methyl-4-[(4-methylphenyl)methyl]-1,4-benzoxazin-3-one

Systemtic Name: (2R)-6-[(1S)-1-azanylpropyl]-2-methyl-4-[(4-methylphenyl)methyl]-1,4-benzoxazin-3-one Openeye Name: (2R)-6-[(1S)-1-aminopropyl]-2-methyl-4-(p-tolylmethyl)-1,4-benzoxazin-3-one CAS Name: (2R)-6-[(1S)-1-aminopropyl]-2-methyl-4-[(4-methylphenyl)methyl]-1,4-benzoxazin-3-one IUPAC Name: (2R)-6-[(1S)-1-aminopropyl]-2-methyl-4-[(4-methylphenyl)methyl]-1,4-benzoxazin-3-one Traditional Name: (2R)-6-[(1S)-1-aminopropyl]-2-methyl-4-(4-methylbenzyl)-1,4-benzoxazin-3-one Formula: C20H24N2O2 MolecularWeight: 324.41676

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1)OC(C(=O)N2CC3=CC=C(C=C3)C)C)N

Isomeric SMILES

CC[C@@H](C1=CC2=C(C=C1)O[C@@H](C(=O)N2CC3=CC=C(C=C3)C)C)N

InChI

InChI=1S/C20H24N2O2/c1-4-17(21)16-9-10-19-18(11-16)22(20(23)14(3)24-19)12-15-7-5-13(2)6-8-15/h5-11,14,17H,4,12,21H2,1-3H3/t14-,17+/m1/s1