1,3-diisocyanato-2-methyl-benzene; ethane-1,2-diamine; 2-methyloxirane

Systemtic Name: 1,3-diisocyanato-2-methyl-benzene; ethane-1,2-diamine; 2-methyloxirane Openeye Name: 1,3-diisocyanato-2-methyl-benzene; ethane-1,2-diamine; 2-methyloxirane CAS Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diamine; 2-methyloxirane IUPAC Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diamine; 2-methyloxirane Traditional Name: 2-aminoethylamine; 1,3-diisocyanato-2-methyl-benzene; propylene oxide Formula: C14H20N4O3 MolecularWeight: 292.3336

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Descriptors Computed from Structure

Canonical SMILES:

CC1CO1.CC1=C(C=CC=C1N=C=O)N=C=O.C(CN)N

Isomeric SMILES

CC1CO1.CC1=C(C=CC=C1N=C=O)N=C=O.C(CN)N

InChI

InChI=1S/C9H6N2O2.C3H6O.C2H8N2/c1-7-8(10-5-12)3-2-4-9(7)11-6-13;1-3-2-4-3;3-1-2-4/h2-4H,1H3;3H,2H2,1H3;1-4H2