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

Systemtic Name: (2R)-6-[(1S)-1-azanylethyl]-2-methyl-4-(3-phenoxypropyl)-1,4-benzoxazin-3-one Openeye Name: (2R)-6-[(1S)-1-aminoethyl]-2-methyl-4-(3-phenoxypropyl)-1,4-benzoxazin-3-one CAS Name: (2R)-6-[(1S)-1-aminoethyl]-2-methyl-4-(3-phenoxypropyl)-1,4-benzoxazin-3-one IUPAC Name: (2R)-6-[(1S)-1-aminoethyl]-2-methyl-4-(3-phenoxypropyl)-1,4-benzoxazin-3-one Traditional Name: (2R)-6-[(1S)-1-aminoethyl]-2-methyl-4-(3-phenoxypropyl)-1,4-benzoxazin-3-one Formula: C20H24N2O3 MolecularWeight: 340.41616

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)C(C)N)CCCOC3=CC=CC=C3

Isomeric SMILES

C[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)[C@H](C)N)CCCOC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O3/c1-14(21)16-9-10-19-18(13-16)22(20(23)15(2)25-19)11-6-12-24-17-7-4-3-5-8-17/h3-5,7-10,13-15H,6,11-12,21H2,1-2H3/t14-,15+/m0/s1