tert-butyl 4-[2-[4-[4-(3-methoxy-3-oxidanylidene-propyl)phenyl]piperazin-1-yl]ethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[4-[4-(3-methoxy-3-oxidanylidene-propyl)phenyl]piperazin-1-yl]ethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-[4-[4-(3-methoxy-3-oxo-propyl)phenyl]piperazin-1-yl]ethyl]piperidine-1-carboxylate CAS Name: 4-[2-[4-[4-(3-methoxy-3-oxopropyl)phenyl]-1-piperazinyl]ethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[4-[4-(3-methoxy-3-oxopropyl)phenyl]piperazin-1-yl]ethyl]piperidine-1-carboxylate Traditional Name: 4-[2-[4-[4-(3-keto-3-methoxy-propyl)phenyl]piperazino]ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H41N3O4 MolecularWeight: 459.62144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCN2CCN(CC2)C3=CC=C(C=C3)CCC(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCN2CCN(CC2)C3=CC=C(C=C3)CCC(=O)OC

InChI

InChI=1S/C26H41N3O4/c1-26(2,3)33-25(31)29-15-12-22(13-16-29)11-14-27-17-19-28(20-18-27)23-8-5-21(6-9-23)7-10-24(30)32-4/h5-6,8-9,22H,7,10-20H2,1-4H3