N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-3-[(2-nitrophenyl)amino]propanamide

Systemtic Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-3-(2-nitroanilino)propanamide CAS Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-3-(2-nitroanilino)propanamide IUPAC Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-3-(2-nitroanilino)propanamide Traditional Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-3-(2-nitroanilino)propionamide Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O5/c1-14(2)21(15-7-8-18-19(13-15)29-12-11-28-18)23-20(25)9-10-22-16-5-3-4-6-17(16)24(26)27/h3-8,13-14,21-22H,9-12H2,1-2H3,(H,23,25)