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

Systemtic Name: 3-(azepan-1-ylmethyl)-N,N-bis(2-chloroethyl)aniline Openeye Name: 3-(azepan-1-ylmethyl)-N,N-bis(2-chloroethyl)aniline CAS Name: 3-(1-azepanylmethyl)-N,N-bis(2-chloroethyl)aniline IUPAC Name: 3-(azepan-1-ylmethyl)-N,N-bis(2-chloroethyl)aniline Traditional Name: [3-(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(=CC=C2)N(CCCl)CCCl

Isomeric SMILES

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

InChI

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