(2R)-4-[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2R)-4-[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2R)-4-[(1S)-2-anilino-1-methyl-2-oxo-ethyl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2R)-4-[(2S)-1-anilino-1-oxopropan-2-yl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2R)-4-[(2S)-1-anilino-1-oxopropan-2-yl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2R)-4-[(1S)-2-anilino-2-keto-1-methyl-ethyl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1CN(C2=CC=CC=C2O1)C(C)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCNC(=O)[C@H]1CN(C2=CC=CC=C2O1)[C@@H](C)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O3/c1-3-13-22-21(26)19-14-24(17-11-7-8-12-18(17)27-19)15(2)20(25)23-16-9-5-4-6-10-16/h4-12,15,19H,3,13-14H2,1-2H3,(H,22,26)(H,23,25)/t15-,19+/m0/s1