methyl 4-[[(2S)-6-azanyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoate

Systemtic Name: methyl 4-[[(2S)-6-azanyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoate Openeye Name: methyl 4-[[(2S)-6-amino-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoate CAS Name: 4-[[(2S)-6-amino-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2S)-6-amino-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoate Traditional Name: 4-[[(2S)-6-amino-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoic acid methyl ester Formula: C19H22N2O3 MolecularWeight: 326.38958

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(C2=C(O1)C=CC(=C2)N)CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O3/c1-3-16-12-21(17-10-15(20)8-9-18(17)24-16)11-13-4-6-14(7-5-13)19(22)23-2/h4-10,16H,3,11-12,20H2,1-2H3/t16-/m0/s1