methyl 4-[[(2S)-7-azanyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoate

Systemtic Name: methyl 4-[[(2S)-7-azanyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoate Openeye Name: methyl 4-[[(2S)-7-amino-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoate CAS Name: 4-[[(2S)-7-amino-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2S)-7-amino-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoate Traditional Name: 4-[[(2S)-7-amino-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoic acid methyl ester Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=C(O1)C=C(C=C2)N)CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O3/c1-12-10-20(16-8-7-15(19)9-17(16)23-12)11-13-3-5-14(6-4-13)18(21)22-2/h3-9,12H,10-11,19H2,1-2H3/t12-/m0/s1