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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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