(phenylmethyl) (3S)-3-[(2S)-2-oxidanyloctyl]-3,6-dihydro-1,2-oxazine-2-carboxylate

Systemtic Name: (phenylmethyl) (3S)-3-[(2S)-2-oxidanyloctyl]-3,6-dihydro-1,2-oxazine-2-carboxylate Openeye Name: benzyl (3S)-3-[(2S)-2-hydroxyoctyl]-3,6-dihydrooxazine-2-carboxylate CAS Name: (3S)-3-[(2S)-2-hydroxyoctyl]-3,6-dihydrooxazine-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (3S)-3-[(2S)-2-hydroxyoctyl]-3,6-dihydrooxazine-2-carboxylate Traditional Name: (3S)-3-[(2S)-2-hydroxyoctyl]-3,6-dihydrooxazine-2-carboxylic acid benzyl ester Formula: C20H29NO4 MolecularWeight: 347.44856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC1C=CCON1C(=O)OCC2=CC=CC=C2)O

Isomeric SMILES

CCCCCC[C@@H](C[C@H]1C=CCON1C(=O)OCC2=CC=CC=C2)O

InChI

InChI=1S/C20H29NO4/c1-2-3-4-8-13-19(22)15-18-12-9-14-25-21(18)20(23)24-16-17-10-6-5-7-11-17/h5-7,9-12,18-19,22H,2-4,8,13-16H2,1H3/t18-,19+/m1/s1