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

Systemtic Name: tert-butyl 4-[2-[4-[4-(3-oxidanylpropylcarbamoyl)phenyl]piperazin-1-yl]ethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-[4-[4-(3-hydroxypropylcarbamoyl)phenyl]piperazin-1-yl]ethyl]piperidine-1-carboxylate CAS Name: 4-[2-[4-[4-[(3-hydroxypropylamino)-oxomethyl]phenyl]-1-piperazinyl]ethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[4-[4-(3-hydroxypropylcarbamoyl)phenyl]piperazin-1-yl]ethyl]piperidine-1-carboxylate Traditional Name: 4-[2-[4-[4-(3-hydroxypropylcarbamoyl)phenyl]piperazino]ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H42N4O4 MolecularWeight: 474.63608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H42N4O4/c1-26(2,3)34-25(33)30-14-10-21(11-15-30)9-13-28-16-18-29(19-17-28)23-7-5-22(6-8-23)24(32)27-12-4-20-31/h5-8,21,31H,4,9-20H2,1-3H3,(H,27,32)