N-[1-[4-[3-(4-cyclopropylcarbonylphenoxy)propyl]piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-3,5-dimethyl-benzamide

Systemtic Name: N-[1-[4-[3-(4-cyclopropylcarbonylphenoxy)propyl]piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-3,5-dimethyl-benzamide Openeye Name: N-[2-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]piperazin-1-yl]-1-methyl-2-oxo-ethyl]-3,5-dimethyl-benzamide CAS Name: N-[1-[4-[3-[4-[cyclopropyl(oxo)methyl]phenoxy]propyl]-1-piperazinyl]-1-oxopropan-2-yl]-3,5-dimethylbenzamide IUPAC Name: N-[1-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]piperazin-1-yl]-1-oxopropan-2-yl]-3,5-dimethylbenzamide Traditional Name: N-[2-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]piperazino]-2-keto-1-methyl-ethyl]-3,5-dimethyl-benzamide Formula: C29H37N3O4 MolecularWeight: 491.62178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NC(C)C(=O)N2CCN(CC2)CCCOC3=CC=C(C=C3)C(=O)C4CC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NC(C)C(=O)N2CCN(CC2)CCCOC3=CC=C(C=C3)C(=O)C4CC4)C

InChI

InChI=1S/C29H37N3O4/c1-20-17-21(2)19-25(18-20)28(34)30-22(3)29(35)32-14-12-31(13-15-32)11-4-16-36-26-9-7-24(8-10-26)27(33)23-5-6-23/h7-10,17-19,22-23H,4-6,11-16H2,1-3H3,(H,30,34)