6-[(1S)-1-azanylethyl]-4-[2-(4-methylphenoxy)ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-[(1S)-1-azanylethyl]-4-[2-(4-methylphenoxy)ethyl]-1,4-benzoxazin-3-one Openeye Name: 6-[(1S)-1-aminoethyl]-4-[2-(4-methylphenoxy)ethyl]-1,4-benzoxazin-3-one CAS Name: 6-[(1S)-1-aminoethyl]-4-[2-(4-methylphenoxy)ethyl]-1,4-benzoxazin-3-one IUPAC Name: 6-[(1S)-1-aminoethyl]-4-[2-(4-methylphenoxy)ethyl]-1,4-benzoxazin-3-one Traditional Name: 6-[(1S)-1-aminoethyl]-4-[2-(4-methylphenoxy)ethyl]-1,4-benzoxazin-3-one Formula: C19H22N2O3 MolecularWeight: 326.38958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCN2C(=O)COC3=C2C=C(C=C3)C(C)N

Isomeric SMILES

CC1=CC=C(C=C1)OCCN2C(=O)COC3=C2C=C(C=C3)[C@H](C)N

InChI

InChI=1S/C19H22N2O3/c1-13-3-6-16(7-4-13)23-10-9-21-17-11-15(14(2)20)5-8-18(17)24-12-19(21)22/h3-8,11,14H,9-10,12,20H2,1-2H3/t14-/m0/s1