N-[(4-benzo[a]anthracen-7-ylphenyl)methyl]-2-chloranyl-N-ethyl-ethanamine hydrochloride

Systemtic Name: N-[(4-benzo[a]anthracen-7-ylphenyl)methyl]-2-chloranyl-N-ethyl-ethanamine hydrochloride Openeye Name: N-[(4-benzo[a]anthracen-7-ylphenyl)methyl]-2-chloro-N-ethyl-ethanamine hydrochloride CAS Name: N-[[4-(7-benzo[a]anthracenyl)phenyl]methyl]-2-chloro-N-ethylethanamine hydrochloride IUPAC Name: N-[(4-benzo[a]anthracen-7-ylphenyl)methyl]-2-chloro-N-ethylethanamine hydrochloride Traditional Name: (4-benz[a]anthracen-7-ylbenzyl)-(2-chloroethyl)-ethyl-amine hydrochloride Formula: C29H27Cl2N MolecularWeight: 460.43738

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCl)CC1=CC=C(C=C1)C2=C3C=CC4=CC=CC=C4C3=CC5=CC=CC=C52.Cl

Isomeric SMILES

CCN(CCCl)CC1=CC=C(C=C1)C2=C3C=CC4=CC=CC=C4C3=CC5=CC=CC=C52.Cl

InChI

InChI=1S/C29H26ClN.ClH/c1-2-31(18-17-30)20-21-11-13-23(14-12-21)29-26-10-6-4-8-24(26)19-28-25-9-5-3-7-22(25)15-16-27(28)29;/h3-16,19H,2,17-18,20H2,1H3;1H