1,3-diisocyanato-2-methyl-benzene; 2-methyloxirane; 2-methylpiperazine; oxirane

Systemtic Name: 1,3-diisocyanato-2-methyl-benzene; 2-methyloxirane; 2-methylpiperazine; oxirane Openeye Name: 1,3-diisocyanato-2-methyl-benzene; 2-methyloxirane; 2-methylpiperazine; oxirane CAS Name: 1,3-diisocyanato-2-methylbenzene; 2-methyloxirane; 2-methylpiperazine; oxirane IUPAC Name: 1,3-diisocyanato-2-methylbenzene; 2-methyloxirane; 2-methylpiperazine; oxirane Traditional Name: 1,3-diisocyanato-2-methyl-benzene; ethylene oxide; 2-methylpiperazine; propylene oxide Formula: C19H28N4O4 MolecularWeight: 376.45002

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCCN1.CC1CO1.CC1=C(C=CC=C1N=C=O)N=C=O.C1CO1

Isomeric SMILES

CC1CNCCN1.CC1CO1.CC1=C(C=CC=C1N=C=O)N=C=O.C1CO1

InChI

InChI=1S/C9H6N2O2.C5H12N2.C3H6O.C2H4O/c1-7-8(10-5-12)3-2-4-9(7)11-6-13;1-5-4-6-2-3-7-5;1-3-2-4-3;1-2-3-1/h2-4H,1H3;5-7H,2-4H2,1H3;3H,2H2,1H3;1-2H2