N-(3-chloranyl-4-piperidin-1-yl-phenyl)-1-(3-ethoxy-2-phenylmethoxy-phenyl)methanimine

Systemtic Name: N-(3-chloranyl-4-piperidin-1-yl-phenyl)-1-(3-ethoxy-2-phenylmethoxy-phenyl)methanimine Openeye Name: 1-(2-benzyloxy-3-ethoxy-phenyl)-N-[3-chloro-4-(1-piperidyl)phenyl]methanimine CAS Name: N-[3-chloro-4-(1-piperidinyl)phenyl]-1-(3-ethoxy-2-phenylmethoxyphenyl)methanimine IUPAC Name: N-(3-chloro-4-piperidin-1-ylphenyl)-1-(3-ethoxy-2-phenylmethoxyphenyl)methanimine Traditional Name: (2-benzoxy-3-ethoxy-benzylidene)-(3-chloro-4-piperidino-phenyl)amine Formula: C27H29ClN2O2 MolecularWeight: 448.98436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1OCC2=CC=CC=C2)C=NC3=CC(=C(C=C3)N4CCCCC4)Cl

Isomeric SMILES

CCOC1=CC=CC(=C1OCC2=CC=CC=C2)C=NC3=CC(=C(C=C3)N4CCCCC4)Cl

InChI

InChI=1S/C27H29ClN2O2/c1-2-31-26-13-9-12-22(27(26)32-20-21-10-5-3-6-11-21)19-29-23-14-15-25(24(28)18-23)30-16-7-4-8-17-30/h3,5-6,9-15,18-19H,2,4,7-8,16-17,20H2,1H3