(2R)-N-cyclopentyl-2-(6-nitro-1,3-benzodioxol-5-yl)-2-[phenyl(prop-2-enyl)amino]ethanamide

Systemtic Name: (2R)-N-cyclopentyl-2-(6-nitro-1,3-benzodioxol-5-yl)-2-[phenyl(prop-2-enyl)amino]ethanamide Openeye Name: (2R)-2-(N-allylanilino)-N-cyclopentyl-2-(6-nitro-1,3-benzodioxol-5-yl)acetamide CAS Name: (2R)-N-cyclopentyl-2-(6-nitro-1,3-benzodioxol-5-yl)-2-(N-prop-2-enylanilino)acetamide IUPAC Name: (2R)-N-cyclopentyl-2-(6-nitro-1,3-benzodioxol-5-yl)-2-(N-prop-2-enylanilino)acetamide Traditional Name: (2R)-2-(N-allylanilino)-N-cyclopentyl-2-(6-nitro-1,3-benzodioxol-5-yl)acetamide Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1=CC=CC=C1)C(C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C(=O)NC4CCCC4

Isomeric SMILES

C=CCN(C1=CC=CC=C1)[C@H](C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C(=O)NC4CCCC4

InChI

InChI=1S/C23H25N3O5/c1-2-12-25(17-10-4-3-5-11-17)22(23(27)24-16-8-6-7-9-16)18-13-20-21(31-15-30-20)14-19(18)26(28)29/h2-5,10-11,13-14,16,22H,1,6-9,12,15H2,(H,24,27)/t22-/m1/s1