[4-[3-ethoxy-4-(pyridin-3-ylmethoxy)phenyl]carbonylpiperazin-1-yl]-(4-propan-2-ylphenyl)methanone

Systemtic Name: [4-[3-ethoxy-4-(pyridin-3-ylmethoxy)phenyl]carbonylpiperazin-1-yl]-(4-propan-2-ylphenyl)methanone Openeye Name: [4-[3-ethoxy-4-(3-pyridylmethoxy)benzoyl]piperazin-1-yl]-(4-isopropylphenyl)methanone CAS Name: [4-[[3-ethoxy-4-(3-pyridinylmethoxy)phenyl]-oxomethyl]-1-piperazinyl]-(4-propan-2-ylphenyl)methanone IUPAC Name: [4-[3-ethoxy-4-(pyridin-3-ylmethoxy)benzoyl]piperazin-1-yl]-(4-propan-2-ylphenyl)methanone Traditional Name: [4-[3-ethoxy-4-(3-pyridylmethoxy)benzoyl]piperazino]-p-cumenyl-methanone Formula: C29H33N3O4 MolecularWeight: 487.59002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C(C)C)OCC4=CN=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C(C)C)OCC4=CN=CC=C4

InChI

InChI=1S/C29H33N3O4/c1-4-35-27-18-25(11-12-26(27)36-20-22-6-5-13-30-19-22)29(34)32-16-14-31(15-17-32)28(33)24-9-7-23(8-10-24)21(2)3/h5-13,18-19,21H,4,14-17,20H2,1-3H3