3-[4-(3-azanylpropyl)piperazin-1-yl]propan-1-amine; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene

Systemtic Name: 3-[4-(3-azanylpropyl)piperazin-1-yl]propan-1-amine; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene Openeye Name: 3-[4-(3-aminopropyl)piperazin-1-yl]propan-1-amine; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene CAS Name: 3-[4-(3-aminopropyl)-1-piperazinyl]-1-propanamine; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene IUPAC Name: 3-[4-(3-aminopropyl)piperazin-1-yl]propan-1-amine; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene Traditional Name: 3-[4-(3-aminopropyl)piperazino]propylamine; 1-isocyanato-4-(4-isocyanatobenzyl)benzene Formula: C25H34N6O2 MolecularWeight: 450.57646

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN)CCCN.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O

Isomeric SMILES

C1CN(CCN1CCCN)CCCN.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O

InChI

InChI=1S/C15H10N2O2.C10H24N4/c18-10-16-14-5-1-12(2-6-14)9-13-3-7-15(8-4-13)17-11-19;11-3-1-5-13-7-9-14(10-8-13)6-2-4-12/h1-8H,9H2;1-12H2