[4-[[[(2R)-4-ethanoyl-2,3-dihydro-1,4-benzoxazin-2-yl]carbonylamino]methyl]phenyl]methyl-diethyl-azanium

Systemtic Name: [4-[[[(2R)-4-ethanoyl-2,3-dihydro-1,4-benzoxazin-2-yl]carbonylamino]methyl]phenyl]methyl-diethyl-azanium Openeye Name: [4-[[[(2R)-4-acetyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl]amino]methyl]phenyl]methyl-diethyl-ammonium CAS Name: [4-[[[[(2R)-4-acetyl-2,3-dihydro-1,4-benzoxazin-2-yl]-oxomethyl]amino]methyl]phenyl]methyl-diethylammonium IUPAC Name: [4-[[[(2R)-4-acetyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl]amino]methyl]phenyl]methyl-diethylazanium Traditional Name: [4-[[[(2R)-4-acetyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl]amino]methyl]benzyl]-diethyl-ammonium Formula: C23H30N3O3+ MolecularWeight: 396.5026

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)C2CN(C3=CC=CC=C3O2)C(=O)C

Isomeric SMILES

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)[C@H]2CN(C3=CC=CC=C3O2)C(=O)C

InChI

InChI=1S/C23H29N3O3/c1-4-25(5-2)15-19-12-10-18(11-13-19)14-24-23(28)22-16-26(17(3)27)20-8-6-7-9-21(20)29-22/h6-13,22H,4-5,14-16H2,1-3H3,(H,24,28)/p+1/t22-/m1/s1