2-chloranyl-N-(2-chloroethyl)-N-(pyren-1-ylmethyl)ethanamine hydrochloride

Systemtic Name: 2-chloranyl-N-(2-chloroethyl)-N-(pyren-1-ylmethyl)ethanamine hydrochloride Openeye Name: 2-chloro-N-(2-chloroethyl)-N-(pyren-1-ylmethyl)ethanamine hydrochloride CAS Name: 2-chloro-N-(2-chloroethyl)-N-(1-pyrenylmethyl)ethanamine hydrochloride IUPAC Name: 2-chloro-N-(2-chloroethyl)-N-(pyren-1-ylmethyl)ethanamine hydrochloride Traditional Name: bis(2-chloroethyl)-(pyren-1-ylmethyl)amine hydrochloride Formula: C21H20Cl3N MolecularWeight: 392.7492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CN(CCCl)CCCl.Cl

Isomeric SMILES

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CN(CCCl)CCCl.Cl

InChI

InChI=1S/C21H19Cl2N.ClH/c22-10-12-24(13-11-23)14-18-7-6-17-5-4-15-2-1-3-16-8-9-19(18)21(17)20(15)16;/h1-9H,10-14H2;1H