N,N-bis(2-chloroethyl)-4-[(5-nitronaphthalen-2-yl)iminomethyl]aniline

Systemtic Name: N,N-bis(2-chloroethyl)-4-[(5-nitronaphthalen-2-yl)iminomethyl]aniline Openeye Name: N,N-bis(2-chloroethyl)-4-[(5-nitro-2-naphthyl)iminomethyl]aniline CAS Name: N,N-bis(2-chloroethyl)-4-[(5-nitro-2-naphthalenyl)iminomethyl]aniline IUPAC Name: N,N-bis(2-chloroethyl)-4-[(5-nitronaphthalen-2-yl)iminomethyl]aniline Traditional Name: bis(2-chloroethyl)-[4-[(5-nitro-2-naphthyl)iminomethyl]phenyl]amine Formula: C21H19Cl2N3O2 MolecularWeight: 416.30046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)N=CC3=CC=C(C=C3)N(CCCl)CCCl)C(=C1)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=CC(=C2)N=CC3=CC=C(C=C3)N(CCCl)CCCl)C(=C1)[N+](=O)[O-]

InChI

InChI=1S/C21H19Cl2N3O2/c22-10-12-25(13-11-23)19-7-4-16(5-8-19)15-24-18-6-9-20-17(14-18)2-1-3-21(20)26(27)28/h1-9,14-15H,10-13H2