methyl 2-[(3S)-4-naphthalen-2-ylsulfonyl-2,3-dihydro-1,4-benzoxazin-3-yl]ethanoate

Systemtic Name: methyl 2-[(3S)-4-naphthalen-2-ylsulfonyl-2,3-dihydro-1,4-benzoxazin-3-yl]ethanoate Openeye Name: methyl 2-[(3S)-4-(2-naphthylsulfonyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetate CAS Name: 2-[(3S)-4-(2-naphthalenylsulfonyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(3S)-4-naphthalen-2-ylsulfonyl-2,3-dihydro-1,4-benzoxazin-3-yl]acetate Traditional Name: 2-[(3S)-4-(2-naphthylsulfonyl)-2,3-dihydro-1,4-benzoxazin-3-yl]acetic acid methyl ester Formula: C21H19NO5S MolecularWeight: 397.44426

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1COC2=CC=CC=C2N1S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

COC(=O)C[C@H]1COC2=CC=CC=C2N1S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H19NO5S/c1-26-21(23)13-17-14-27-20-9-5-4-8-19(20)22(17)28(24,25)18-11-10-15-6-2-3-7-16(15)12-18/h2-12,17H,13-14H2,1H3/t17-/m0/s1