ethyl 4-[6-[(3,5-dimethoxyphenyl)methoxy]-3-oxidanylidene-4-propan-2-yl-1,4-diazepan-1-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[6-[(3,5-dimethoxyphenyl)methoxy]-3-oxidanylidene-4-propan-2-yl-1,4-diazepan-1-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[6-[(3,5-dimethoxyphenyl)methoxy]-4-isopropyl-3-oxo-1,4-diazepan-1-yl]piperidine-1-carboxylate CAS Name: 4-[6-[(3,5-dimethoxyphenyl)methoxy]-3-oxo-4-propan-2-yl-1,4-diazepan-1-yl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6-[(3,5-dimethoxyphenyl)methoxy]-3-oxo-4-propan-2-yl-1,4-diazepan-1-yl]piperidine-1-carboxylate Traditional Name: 4-[6-(3,5-dimethoxybenzyl)oxy-4-isopropyl-3-keto-1,4-diazepan-1-yl]piperidine-1-carboxylic acid ethyl ester Formula: C25H39N3O6 MolecularWeight: 477.59366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2CC(CN(C(=O)C2)C(C)C)OCC3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2CC(CN(C(=O)C2)C(C)C)OCC3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C25H39N3O6/c1-6-33-25(30)26-9-7-20(8-10-26)27-14-23(15-28(18(2)3)24(29)16-27)34-17-19-11-21(31-4)13-22(12-19)32-5/h11-13,18,20,23H,6-10,14-17H2,1-5H3