[3-phenoxy-4-[(4-propan-2-ylpiperazin-1-yl)methyl]phenyl]-piperidin-1-yl-methanone

Systemtic Name: [3-phenoxy-4-[(4-propan-2-ylpiperazin-1-yl)methyl]phenyl]-piperidin-1-yl-methanone Openeye Name: [4-[(4-isopropylpiperazin-1-yl)methyl]-3-phenoxy-phenyl]-(1-piperidyl)methanone CAS Name: [3-phenoxy-4-[(4-propan-2-yl-1-piperazinyl)methyl]phenyl]-(1-piperidinyl)methanone IUPAC Name: [3-phenoxy-4-[(4-propan-2-ylpiperazin-1-yl)methyl]phenyl]-piperidin-1-ylmethanone Traditional Name: [4-[(4-isopropylpiperazino)methyl]-3-phenoxy-phenyl]-piperidino-methanone Formula: C26H35N3O2 MolecularWeight: 421.575

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)CC2=C(C=C(C=C2)C(=O)N3CCCCC3)OC4=CC=CC=C4

Isomeric SMILES

CC(C)N1CCN(CC1)CC2=C(C=C(C=C2)C(=O)N3CCCCC3)OC4=CC=CC=C4

InChI

InChI=1S/C26H35N3O2/c1-21(2)28-17-15-27(16-18-28)20-23-12-11-22(26(30)29-13-7-4-8-14-29)19-25(23)31-24-9-5-3-6-10-24/h3,5-6,9-12,19,21H,4,7-8,13-18,20H2,1-2H3