4-(azepan-1-ylmethyl)-N,N-bis(2-chloroethyl)aniline

Systemtic Name: 4-(azepan-1-ylmethyl)-N,N-bis(2-chloroethyl)aniline Openeye Name: 4-(azepan-1-ylmethyl)-N,N-bis(2-chloroethyl)aniline CAS Name: 4-(1-azepanylmethyl)-N,N-bis(2-chloroethyl)aniline IUPAC Name: 4-(azepan-1-ylmethyl)-N,N-bis(2-chloroethyl)aniline Traditional Name: [4-(azepan-1-ylmethyl)phenyl]-bis(2-chloroethyl)amine Formula: C17H26Cl2N2 MolecularWeight: 329.30774

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=CC=C(C=C2)N(CCCl)CCCl

Isomeric SMILES

C1CCCN(CC1)CC2=CC=C(C=C2)N(CCCl)CCCl

InChI

InChI=1S/C17H26Cl2N2/c18-9-13-21(14-10-19)17-7-5-16(6-8-17)15-20-11-3-1-2-4-12-20/h5-8H,1-4,9-15H2