[(1S)-1-[3-oxidanylidene-4-(2-oxidanylidene-2-phenylazanyl-ethyl)-1,4-benzoxazin-6-yl]propyl]azanium

Systemtic Name: [(1S)-1-[3-oxidanylidene-4-(2-oxidanylidene-2-phenylazanyl-ethyl)-1,4-benzoxazin-6-yl]propyl]azanium Openeye Name: [(1S)-1-[4-(2-anilino-2-oxo-ethyl)-3-oxo-1,4-benzoxazin-6-yl]propyl]ammonium CAS Name: [(1S)-1-[4-(2-anilino-2-oxoethyl)-3-oxo-1,4-benzoxazin-6-yl]propyl]ammonium IUPAC Name: [(1S)-1-[4-(2-anilino-2-oxoethyl)-3-oxo-1,4-benzoxazin-6-yl]propyl]azanium Traditional Name: [(1S)-1-[4-(2-anilino-2-keto-ethyl)-3-keto-1,4-benzoxazin-6-yl]propyl]ammonium Formula: C19H22N3O3+ MolecularWeight: 340.39628

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1)OCC(=O)N2CC(=O)NC3=CC=CC=C3)[NH3+]

Isomeric SMILES

CC[C@@H](C1=CC2=C(C=C1)OCC(=O)N2CC(=O)NC3=CC=CC=C3)[NH3+]

InChI

InChI=1S/C19H21N3O3/c1-2-15(20)13-8-9-17-16(10-13)22(19(24)12-25-17)11-18(23)21-14-6-4-3-5-7-14/h3-10,15H,2,11-12,20H2,1H3,(H,21,23)/p+1/t15-/m0/s1