4-(cyclopropylamino)-N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-N-methyl-3-nitro-benzamide

Systemtic Name: 4-(cyclopropylamino)-N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-N-methyl-3-nitro-benzamide Openeye Name: 4-(cyclopropylamino)-N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-N-methyl-3-nitro-benzamide CAS Name: 4-(cyclopropylamino)-N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-N-methyl-3-nitrobenzamide IUPAC Name: 4-(cyclopropylamino)-N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-N-methyl-3-nitrobenzamide Traditional Name: 4-(cyclopropylamino)-N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-N-methyl-3-nitro-benzamide Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(OC2=CC=CC=C21)CN(C)C(=O)C3=CC(=C(C=C3)NC4CC4)[N+](=O)[O-]

Isomeric SMILES

CCN1C[C@H](OC2=CC=CC=C21)CN(C)C(=O)C3=CC(=C(C=C3)NC4CC4)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O4/c1-3-25-14-17(30-21-7-5-4-6-19(21)25)13-24(2)22(27)15-8-11-18(23-16-9-10-16)20(12-15)26(28)29/h4-8,11-12,16-17,23H,3,9-10,13-14H2,1-2H3/t17-/m1/s1