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N,N-bis(2-chloroethyl)-4-(6,7-dimethoxyisoquinolin-1-yl)aniline

N,N-bis(2-chloroethyl)-4-(6,7-dimethoxyisoquinolin-1-yl)aniline

Systemtic Name:N,N-bis(2-chloroethyl)-4-(6,7-dimethoxyisoquinolin-1-yl)aniline
Openeye Name:N,N-bis(2-chloroethyl)-4-(6,7-dimethoxy-1-isoquinolyl)aniline
CAS Name:N,N-bis(2-chloroethyl)-4-(6,7-dimethoxy-1-isoquinolinyl)aniline
IUPAC Name:N,N-bis(2-chloroethyl)-4-(6,7-dimethoxyisoquinolin-1-yl)aniline
Traditional Name:bis(2-chloroethyl)-[4-(6,7-dimethoxy-1-isoquinolyl)phenyl]amine
Formula: C21H22Cl2N2O2
MolecularWeight: 405.31758
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=CN=C2C3=CC=C(C=C3)N(CCCl)CCCl)OC


Isomeric SMILES

COC1=C(C=C2C(=C1)C=CN=C2C3=CC=C(C=C3)N(CCCl)CCCl)OC


InChI

InChI=1S/C21H22Cl2N2O2/c1-26-19-13-16-7-10-24-21(18(16)14-20(19)27-2)15-3-5-17(6-4-15)25(11-8-22)12-9-23/h3-7,10,13-14H,8-9,11-12H2,1-2H3


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