(2R)-2-azanyl-1-[4-[3-(4-cyclopropylcarbonylphenoxy)propyl]piperazin-1-yl]-4-phenyl-butan-1-one

Systemtic Name: (2R)-2-azanyl-1-[4-[3-(4-cyclopropylcarbonylphenoxy)propyl]piperazin-1-yl]-4-phenyl-butan-1-one Openeye Name: (2R)-2-amino-1-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]piperazin-1-yl]-4-phenyl-butan-1-one CAS Name: (2R)-2-amino-1-[4-[3-[4-[cyclopropyl(oxo)methyl]phenoxy]propyl]-1-piperazinyl]-4-phenyl-1-butanone IUPAC Name: (2R)-2-amino-1-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]piperazin-1-yl]-4-phenylbutan-1-one Traditional Name: (2R)-2-amino-1-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]piperazino]-4-phenyl-butan-1-one Formula: C27H35N3O3 MolecularWeight: 449.5851

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)C2=CC=C(C=C2)OCCCN3CCN(CC3)C(=O)C(CCC4=CC=CC=C4)N

Isomeric SMILES

C1CC1C(=O)C2=CC=C(C=C2)OCCCN3CCN(CC3)C(=O)[C@@H](CCC4=CC=CC=C4)N

InChI

InChI=1S/C27H35N3O3/c28-25(14-7-21-5-2-1-3-6-21)27(32)30-18-16-29(17-19-30)15-4-20-33-24-12-10-23(11-13-24)26(31)22-8-9-22/h1-3,5-6,10-13,22,25H,4,7-9,14-20,28H2/t25-/m1/s1