3-[3-(dimethylaminomethyl)phenoxy]-N-[(Z)-1-methylsulfanyl-2-nitro-ethenyl]propan-1-amine

Systemtic Name: 3-[3-(dimethylaminomethyl)phenoxy]-N-[(Z)-1-methylsulfanyl-2-nitro-ethenyl]propan-1-amine Openeye Name: 3-[3-(dimethylaminomethyl)phenoxy]-N-[(Z)-1-methylsulfanyl-2-nitro-vinyl]propan-1-amine CAS Name: 3-[3-(dimethylaminomethyl)phenoxy]-N-[(Z)-1-(methylthio)-2-nitroethenyl]-1-propanamine IUPAC Name: 3-[3-(dimethylaminomethyl)phenoxy]-N-[(Z)-1-methylsulfanyl-2-nitroethenyl]propan-1-amine Traditional Name: dimethyl-[3-[3-[[(Z)-1-(methylthio)-2-nitro-vinyl]amino]propoxy]benzyl]amine Formula: C15H23N3O3S MolecularWeight: 325.42642

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC(=CC=C1)OCCCNC(=C[N+](=O)[O-])SC

Isomeric SMILES

CN(C)CC1=CC(=CC=C1)OCCCN/C(=C/[N+](=O)[O-])/SC

InChI

InChI=1S/C15H23N3O3S/c1-17(2)11-13-6-4-7-14(10-13)21-9-5-8-16-15(22-3)12-18(19)20/h4,6-7,10,12,16H,5,8-9,11H2,1-3H3/b15-12-