1-[(3,4-dimethoxyphenyl)-(3-ethoxy-4-methoxy-phenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(3,4-dimethoxyphenyl)-(3-ethoxy-4-methoxy-phenyl)methyl]-1,4-diazepane Openeye Name: 1-[(3,4-dimethoxyphenyl)-(3-ethoxy-4-methoxy-phenyl)methyl]-1,4-diazepane CAS Name: 1-[(3,4-dimethoxyphenyl)-(3-ethoxy-4-methoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3,4-dimethoxyphenyl)-(3-ethoxy-4-methoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(3,4-dimethoxyphenyl)-(3-ethoxy-4-methoxy-phenyl)methyl]-1,4-diazepane Formula: C23H32N2O4 MolecularWeight: 400.51118

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C2=CC(=C(C=C2)OC)OC)N3CCCNCC3)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C2=CC(=C(C=C2)OC)OC)N3CCCNCC3)OC

InChI

InChI=1S/C23H32N2O4/c1-5-29-22-16-18(8-10-20(22)27-3)23(25-13-6-11-24-12-14-25)17-7-9-19(26-2)21(15-17)28-4/h7-10,15-16,23-24H,5-6,11-14H2,1-4H3