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

Systemtic Name: methyl 4-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methyl-carbamoyl]benzoate Openeye Name: methyl 4-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methyl-carbamoyl]benzoate CAS Name: 4-[[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methylamino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methylcarbamoyl]benzoate Traditional Name: 4-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methyl-carbamoyl]benzoic acid methyl ester Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(OC2=CC=CC=C21)CN(C)C(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCN1C[C@H](OC2=CC=CC=C21)CN(C)C(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H24N2O4/c1-4-23-14-17(27-19-8-6-5-7-18(19)23)13-22(2)20(24)15-9-11-16(12-10-15)21(25)26-3/h5-12,17H,4,13-14H2,1-3H3/t17-/m1/s1