4-[1,4-diazepan-1-yl-(3-methoxy-4-phenylmethoxy-phenyl)methyl]-N,N-dimethyl-aniline

Systemtic Name: 4-[1,4-diazepan-1-yl-(3-methoxy-4-phenylmethoxy-phenyl)methyl]-N,N-dimethyl-aniline Openeye Name: 4-[(4-benzyloxy-3-methoxy-phenyl)-(1,4-diazepan-1-yl)methyl]-N,N-dimethyl-aniline CAS Name: 4-[1,4-diazepan-1-yl-(3-methoxy-4-phenylmethoxyphenyl)methyl]-N,N-dimethylaniline IUPAC Name: 4-[1,4-diazepan-1-yl-(3-methoxy-4-phenylmethoxyphenyl)methyl]-N,N-dimethylaniline Traditional Name: [4-[(4-benzoxy-3-methoxy-phenyl)-(1,4-diazepan-1-yl)methyl]phenyl]-dimethyl-amine Formula: C28H35N3O2 MolecularWeight: 445.5964

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)N4CCCNCC4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)N4CCCNCC4

InChI

InChI=1S/C28H35N3O2/c1-30(2)25-13-10-23(11-14-25)28(31-18-7-16-29-17-19-31)24-12-15-26(27(20-24)32-3)33-21-22-8-5-4-6-9-22/h4-6,8-15,20,28-29H,7,16-19,21H2,1-3H3