N,N-bis(2-chloroethyl)-3-methyl-4-(pyren-1-yliminomethyl)aniline

Systemtic Name: N,N-bis(2-chloroethyl)-3-methyl-4-(pyren-1-yliminomethyl)aniline Openeye Name: N,N-bis(2-chloroethyl)-3-methyl-4-(pyren-1-yliminomethyl)aniline CAS Name: N,N-bis(2-chloroethyl)-3-methyl-4-(1-pyrenyliminomethyl)aniline IUPAC Name: N,N-bis(2-chloroethyl)-3-methyl-4-(pyren-1-yliminomethyl)aniline Traditional Name: bis(2-chloroethyl)-[3-methyl-4-(pyren-1-yliminomethyl)phenyl]amine Formula: C28H24Cl2N2 MolecularWeight: 459.40956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(CCCl)CCCl)C=NC2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2

Isomeric SMILES

CC1=C(C=CC(=C1)N(CCCl)CCCl)C=NC2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2

InChI

InChI=1S/C28H24Cl2N2/c1-19-17-24(32(15-13-29)16-14-30)10-7-23(19)18-31-26-12-9-22-6-5-20-3-2-4-21-8-11-25(26)28(22)27(20)21/h2-12,17-18H,13-16H2,1H3