(2S)-2-[(2S)-7-azanyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]-N-(4-ethylphenyl)propanamide

Systemtic Name: (2S)-2-[(2S)-7-azanyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]-N-(4-ethylphenyl)propanamide Openeye Name: (2S)-2-[(2S)-7-amino-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]-N-(4-ethylphenyl)propanamide CAS Name: (2S)-2-[(2S)-7-amino-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]-N-(4-ethylphenyl)propanamide IUPAC Name: (2S)-2-[(2S)-7-amino-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]-N-(4-ethylphenyl)propanamide Traditional Name: (2S)-2-[(2S)-7-amino-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]-N-(4-ethylphenyl)propionamide Formula: C21H27N3O2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(C2=C(O1)C=C(C=C2)N)C(C)C(=O)NC3=CC=C(C=C3)CC

Isomeric SMILES

CC[C@H]1CN(C2=C(O1)C=C(C=C2)N)[C@@H](C)C(=O)NC3=CC=C(C=C3)CC

InChI

InChI=1S/C21H27N3O2/c1-4-15-6-9-17(10-7-15)23-21(25)14(3)24-13-18(5-2)26-20-12-16(22)8-11-19(20)24/h6-12,14,18H,4-5,13,22H2,1-3H3,(H,23,25)/t14-,18-/m0/s1